Compound Identification
SMILES
COC1=CC2=C(NC=C2CCN=CC2=C(C(O)=O)C(OC)=C(OC)C=C2)C=C1
InChIKey
InChIKey=YMEDETLGYBJNIB-UHFFFAOYSA-N
Formula
C21H22N2O5
Mass
382.416
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Methoxybenzoic acids and derivatives
Direct Parent
O-methoxybenzoic acids and derivatives
Alternative Parents
M-methoxybenzoic acids and derivatives 3-alkylindoles Dimethoxybenzenes Benzoic acids Anisoles Benzoyl derivatives Phenoxy compounds Alkyl aryl ethers Substituted pyrroles Heteroaromatic compounds Shiff bases Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-methoxybenzoic acid or derivatives - O-methoxybenzoic acid or derivatives - O-dimethoxybenzene - Dimethoxybenzene - 3-alkylindole - Benzoic acid - Indole - Indole or derivatives - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Shiff base - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Aldimine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Imine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as o-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 2 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available