Compound Identification
SMILES
OC(=O)C1=C(NC2=CC(OCC3=CC=CC=C3)=CC=C2)C=CC(=C1)[N+]([O-])=O
InChIKey
InChIKey=RFMQORSUFPVEJU-UHFFFAOYSA-N
Formula
C20H16N2O5
Mass
364.357
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Nitrobenzoic acids and derivatives
Alternative Parents
Aminobenzoic acids Aminophenyl ethers Benzoic acids Nitrobenzenes Phenoxy compounds Nitroaromatic compounds Benzoyl derivatives Aniline and substituted anilines Alkyl aryl ethers Primary aromatic amines Vinylogous amides Amino acids Organic oxoazanium compounds Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Secondary amines Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzoate - Aminobenzoic acid - Aminobenzoic acid or derivatives - Aminophenyl ether - Benzoic acid - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Benzoyl - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Primary aromatic amine - Vinylogous amide - Amino acid or derivatives - Amino acid - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic salt - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzoic acids and derivatives. These are compounds containing a nitrobenzoic acid moiety, which consists of a benzene ring bearing both a carboxylic acid group and a nitro group on two different ring carbon atoms.
External Descriptors
Not available