Compound Identification
SMILES
COC1=CC=CC(C(O)=O)=C1NC1=CC(=C(OCC2=CC=CC=C2)C=C1)[N+]([O-])=O
InChIKey
InChIKey=JHJKRRSNWVIAJA-UHFFFAOYSA-N
Formula
C21H18N2O6
Mass
394.383
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
M-methoxybenzoic acids and derivatives
Alternative Parents
Nitrophenyl ethers Aminobenzoic acids Aminophenyl ethers Benzoic acids Methoxyanilines Anisoles Benzoyl derivatives Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers Primary aromatic amines Vinylogous amides Amino acids Secondary amines Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
M-methoxybenzoic acid or derivatives - Nitrophenyl ether - Aminobenzoic acid - Aminobenzoic acid or derivatives - Nitrobenzene - Aminophenyl ether - Benzoic acid - Methoxyaniline - Phenol ether - Phenoxy compound - Benzoyl - Nitroaromatic compound - Anisole - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Primary aromatic amine - Vinylogous amide - Amino acid or derivatives - C-nitro compound - Organic nitro compound - Amino acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as m-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 3 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available