Compound Identification
SMILES
CC1=CC=CC=C1C(=O)NC[C@H](N)[C@@H](O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=JQWFQMBICJSYHS-HOTGVXAUSA-N
Formula
C17H19N3O4
Mass
329.356
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
o-Toluamides Benzamides Benzoyl derivatives Nitroaromatic compounds Aralkylamines Amino acids and derivatives 1,2-aminoalcohols Secondary carboxylic acid amides Secondary alcohols Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic zwitterions Organic salts Organic oxides Monoalkylamines Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzamide - Benzoic acid or derivatives - O-toluamide - Toluamide - Nitrobenzene - Nitroaromatic compound - Benzoyl - Toluene - Aralkylamine - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - C-nitro compound - Secondary alcohol - Secondary carboxylic acid amide - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Alcohol - Primary aliphatic amine - Organic salt - Amine - Organic oxide - Organic oxygen compound - Aromatic alcohol - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available