Compound Identification
SMILES
CCOC1=C(OC)C=C(C=C1Cl)C(=O)OC(C)C(=O)NC1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=HTQIKUZDOPTLPK-UHFFFAOYSA-N
Formula
C21H22ClNO7
Mass
435.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Methoxybenzoic acids and derivatives
Direct Parent
M-methoxybenzoic acids and derivatives
Alternative Parents
3-halobenzoic acids and derivatives Benzo-1,4-dioxanes Benzoic acid esters Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Para dioxins Aryl chlorides Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-methoxybenzoic acid or derivatives - Benzoate ester - Benzodioxane - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzo-1,4-dioxane - Methoxybenzene - N-arylamide - Benzoyl - Phenol ether - Anisole - Phenoxy compound - Chlorobenzene - Halobenzene - Alkyl aryl ether - Para-dioxin - Aryl halide - Aryl chloride - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Ether - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as m-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 3 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available