Compound Identification
SMILES
CCCCC1=C(C(=O)C2=CC3=C(C=C2)C(Br)=C(OC(CC2=CC=CC=C2)C(O)=O)C=C3)C2=CC=CC=C2O1
InChIKey
InChIKey=JODMKVJBCWXIBI-UHFFFAOYSA-N
Formula
C32H27BrO5
Mass
571.467
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- 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 and derivatives
Alternative Parents
Phenylpropanoic acids Phenoxyacetic acid derivatives Benzofurans Phenol ethers Aryl ketones 3-aroylfurans Alkyl aryl ethers Aryl bromides Heteroaromatic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalenecarboxylic acid or derivatives - 3-phenylpropanoic-acid - Phenoxyacetate - Benzofuran - Aryl ketone - 3-aroylfuran - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Furan - Ketone - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids and derivatives. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group or a derivative at one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available