Compound Identification
SMILES
COC(=O)[C@@H]1[C@@H](CCC2=C1C(OC)=CC=C2)NCC=C
InChIKey
InChIKey=KPSNWTKMLGIJQK-IUODEOHRSA-N
Formula
C16H21NO3
Mass
275.348
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
Beta amino acids and derivatives Tetralins Anisoles Aralkylamines Alkyl aryl ethers Methyl esters Monocarboxylic acids and derivatives Dialkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
1-naphthalenecarboxylic acid or derivatives - Beta amino acid or derivatives - Tetralin - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Methyl ester - Carboxylic acid ester - Amino acid or derivatives - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Carboxylic acid derivative - Secondary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Aromatic homopolycyclic 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