Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(=O)OC1=C(C=NNC(=O)C2=NC=CN=C2)C2=CC=CC=C2C=C1
InChIKey
InChIKey=RIJACNHRVXHKGP-UHFFFAOYSA-N
Formula
C25H20N4O5
Mass
456.458
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
P-methoxybenzoic acids and derivatives
Alternative Parents
M-methoxybenzoic acids and derivatives Phenol esters Naphthalenes Dimethoxybenzenes Benzoic acid esters Pyrazinecarboxamides Phenoxy compounds Anisoles Benzoyl derivatives Alkyl aryl ethers Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-methoxybenzoic acid or derivatives - P-methoxybenzoic acid or derivatives - Benzoate ester - Naphthalene - Phenol ester - Dimethoxybenzene - O-dimethoxybenzene - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyrazine - Heteroaromatic compound - Carboxylic acid ester - Ether - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 4 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available