Compound Identification
SMILES
ClC1=C(C=CC2=C1C(=O)C1=CC=CC=C1C2=O)C(=O)OCC1=CC=C(C=C1)C#N
InChIKey
InChIKey=FIXBOARCVRNZPJ-UHFFFAOYSA-N
Formula
C23H12ClNO4
Mass
401.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Anthracenes
-
Subclass
Anthracenecarboxylic acids and derivatives
- Level 5 Anthracenecarboxylic acids
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Subclass
Anthracenecarboxylic acids and derivatives
-
Class
Anthracenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Anthracenes
Subclass
Anthracenecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Anthracenecarboxylic acids
Alternative Parents
Anthraquinones Naphthalenecarboxylic acids Benzyloxycarbonyls 2-halobenzoic acids and derivatives Benzonitriles Aryl ketones Aryl chlorides Vinylogous halides Carboxylic acid esters Nitriles Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Anthracene carboxylic acid - 9,10-anthraquinone - Anthraquinone - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - Benzyloxycarbonyl - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzonitrile - Aryl ketone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous halide - Ketone - Carboxylic acid ester - Carbonitrile - Carboxylic acid derivative - Nitrile - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Cyanide - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as anthracenecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an anthracene ring system.
External Descriptors
Not available