Compound Identification
SMILES
COC(=O)C1=C(N)C(OC)=C(N)C(C(=O)OC)=C1OC
InChIKey
InChIKey=QWJJQARBTIXKSK-UHFFFAOYSA-N
Formula
C12H16N2O6
Mass
284.268
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Phthalic acid and derivatives
-
Level 6
Phthalate esters
- Level 7 m-Phthalate esters
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Level 6
Phthalate esters
-
Level 5
Phthalic acid and derivatives
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Phthalic acid and derivatives - Phthalate esters
Direct Parent
m-Phthalate esters
Alternative Parents
M-phthalic acid and derivatives O-methoxybenzoic acids and derivatives M-methoxybenzoic acids and derivatives Aminobenzoic acids and derivatives Benzoic acid esters Dimethoxybenzenes Aminophenyl ethers Methoxyanilines Anisoles Phenoxy compounds Benzoyl derivatives M-phenylenediamines Alkyl aryl ethers Vinylogous amides Methyl esters Amino acids and derivatives Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Meta-phthalic acid ester - Meta_phthalic_acid - M-methoxybenzoic acid or derivatives - O-methoxybenzoic acid or derivatives - Benzoate ester - Dimethoxybenzene - P-dimethoxybenzene - Aminobenzoic acid or derivatives - Methoxyaniline - Aminophenyl ether - Methoxybenzene - Phenylenediamine - M-phenylenediamine - Phenoxy compound - Aniline or substituted anilines - Phenol ether - Benzoyl - Anisole - Alkyl aryl ether - Vinylogous amide - Methyl ester - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.
External Descriptors
Not available