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A chemical formula used for a series of compounds that differ from each other by a constant unit is called a general formula. It generates a homologous series of chemical formulae. For example, alcohols may be represented by the formula C n H 2n + 1 OH (n ≥ 1), giving the homologs methanol, ethanol, propanol for 1 ≤ n ≤ 3.
Chemical symbols are the ... while for others, the name is a more recent invention. For example, ... Modern alphabetic notation was introduced in 1814 ...
A chemical equation is the symbolic representation of a chemical reaction in the form of symbols and chemical formulas.The reactant entities are given on the left-hand side and the product entities are on the right-hand side with a plus sign between the entities in both the reactants and the products, and an arrow that points towards the products to show the direction of the reaction. [1]
The SMILES notation is described extensively in the SMILES theory manual provided by Daylight Chemical Information Systems and a number of illustrative examples are presented. Daylight's depict utility provides users with the means to check their own examples of SMILES and is a valuable educational tool.
For example, many chemical compounds exist in different isomeric forms, which have different enantiomeric structures but the same molecular formula. There are multiple types of ways to draw these structural formulas such as: Lewis structures , condensed formulas, skeletal formulas , Newman projections , Cyclohexane conformations , Haworth ...
Subscripts are used in chemical formulas. For example, the chemical formula for glucose is C 6 H 12 O 6 (meaning that it is a molecule with 6 carbon atoms, 12 hydrogen atoms and 6 oxygen atoms). The chemical formula of the water molecule, H 2 O, indicates that it contains two hydrogen atoms and one oxygen atom.
IUPAC nomenclature is used for the naming of chemical compounds, based on their chemical composition and their structure. [1] For example, one can deduce that 1-chloropropane has a Chlorine atom on the first carbon in the 3-carbon propane chain.
The SYBYL line notation or SLN is a specification for unambiguously describing the structure of chemical molecules using short ASCII strings. SLN differs from SMILES in several significant ways. SLN can specify molecules, molecular queries, and reactions in a single line notation whereas SMILES handles these through language extensions.