Compound Identification
SMILES
CC1=CC=C(O1)C=C1OC2=C(C=CC(OC(=O)C3=CC=C(Cl)C=C3)=C2)C1=O
InChIKey
InChIKey=PZFNVIYVPSEECK-UHFFFAOYSA-N
Formula
C21H13ClO5
Mass
380.78
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
4-halobenzoic acids and derivatives Benzofurans Coumarans Benzoyl derivatives Aryl ketones Chlorobenzenes Aryl chlorides Heteroaromatic compounds Furans Carboxylic acid esters Monocarboxylic acids and derivatives Oxacyclic compounds Hydrocarbon derivatives Aldehydes Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzofuran - Coumaran - Benzoyl - Aryl ketone - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Heteroaromatic compound - Furan - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Aldehyde - Organic oxide - Organic oxygen compound - Organochloride - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available