Compound Identification
SMILES
CCCCC1=C(C(=O)C2=CC3=C(C=C2)C(Br)=C(OCC(O)=O)C=C3)C2=CC=CC=C2O1
InChIKey
InChIKey=ZHHHKZSFDMDPEU-UHFFFAOYSA-N
Formula
C25H21BrO5
Mass
481.342
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
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 - Phenoxyacetate - Benzofuran - Aryl ketone - 3-aroylfuran - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Heteroaromatic compound - Furan - Ketone - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Carbonyl group - 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