Compound Identification
SMILES
CC1=C(NC(=O)COC(=O)C2=CC=C(OCC(N)=O)C=C2)C=CC(=C1)[N+]([O-])=O
InChIKey
InChIKey=FDGPNOQOSSSSEO-UHFFFAOYSA-N
Formula
C18H17N3O7
Mass
387.348
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
Anilides Nitrobenzenes Nitrotoluenes Benzoyl derivatives Phenoxy compounds Phenol ethers N-arylamides Nitroaromatic compounds Alkyl aryl ethers Secondary carboxylic acid amides Primary carboxylic acid amides Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Carbonyl compounds Organic salts Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoate ester - Nitrobenzene - Nitrotoluene - Anilide - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - N-arylamide - Alkyl aryl ether - Toluene - Carboxamide group - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Primary carboxylic acid amide - Secondary carboxylic acid amide - Organic oxoazanium - Ether - Carboxylic acid derivative - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organic zwitterion - Aromatic homomonocyclic 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