Compound Identification
SMILES
CCOC(=O)NC1=NC(N)=C(C(NCC(=O)CN(C)C2=CC=C(C=C2)C(=O)OC)=C1)[N+]([O-])=O
InChIKey
InChIKey=OZUGMJPAWIYSMH-UHFFFAOYSA-N
Formula
C20H24N6O7
Mass
460.447
Taxonomic Classification
Taxonomy Tree
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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
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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
Aminobenzoic acids and derivatives Nitroaromatic compounds Dialkylarylamines Benzoyl derivatives Aniline and substituted anilines Secondary alkylarylamines Aminopyridines and derivatives Imidolactams Methyl esters Heteroaromatic compounds Carbamate esters Alpha-amino ketones Organic carbonic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Azacyclic compounds Primary amines Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Aminobenzoic acid or derivatives - Nitroaromatic compound - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Benzoyl - Secondary aliphatic/aromatic amine - Aminopyridine - Imidolactam - Pyridine - Heteroaromatic compound - Methyl ester - Carbamic acid ester - Alpha-aminoketone - Organic nitro compound - Tertiary amine - Carbonic acid derivative - C-nitro compound - Ketone - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Primary amine - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aromatic heteromonocyclic 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