Compound Identification
SMILES
BrC1=C(C=CC2=CC=CC=C12)C(=O)OC1=CC(=O)OC1
InChIKey
InChIKey=CGKTXMUJHDOFSD-UHFFFAOYSA-N
Formula
C15H9BrO4
Mass
333.137
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalenecarboxylic acids and derivatives
- Level 5 Naphthalenecarboxylic acids
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Subclass
Naphthalenecarboxylic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalenecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenecarboxylic acids
Alternative Parents
2-halobenzoic acids and derivatives Dicarboxylic acids and derivatives Butenolides Aryl bromides Vinylogous halides Enol esters Enoate esters Lactones Oxacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalenecarboxylic acid - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Aryl bromide - Aryl halide - 2-furanone - Dicarboxylic acid or derivatives - Dihydrofuran - Vinylogous halide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Enol ester - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available