Compound Identification
SMILES
COC(=O)C1=CC=C(OC(=O)C2CN(C(=O)C2)C2=CC3=C(OCCO3)C=C2)C=C1
InChIKey
InChIKey=CYGTXCMJCRHAHN-UHFFFAOYSA-N
Formula
C21H19NO7
Mass
397.383
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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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
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Phenol esters Benzo-1,4-dioxanes Pyrrolidine carboxylic acids Phenoxy compounds Oxoprolines Benzoyl derivatives Alkyl aryl ethers Pyrrolidine-2-ones Para dioxins Tertiary carboxylic acid amides Methyl esters Lactams Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Benzodioxane - Benzoate ester - Phenol ester - Phenoxy compound - Benzoyl - Oxoproline - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Para-dioxin - 2-pyrrolidone - Pyrrolidone - Methyl ester - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Lactam - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available