Compound Identification
SMILES
CC(C)(C)C1=CC=C(COC(=O)C2=C(Cl)C3=C(C=C2)C(=O)C2=CC=CC=C2C3=O)C=C1
InChIKey
InChIKey=NPTMXTIWGVJBCQ-UHFFFAOYSA-N
Formula
C26H21ClO4
Mass
432.9
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 Phenylpropanes Aryl ketones Aryl chlorides Vinylogous halides Carboxylic acid esters 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 - Phenylpropane - Aryl ketone - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Vinylogous halide - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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