Compound Identification
SMILES
CC1=C(C=CC(=C1)C(=O)OC1=C2N=CC=CC2=C(Cl)C=C1)[N+]([O-])=O
InChIKey
InChIKey=OFWWUARMAXVJMB-UHFFFAOYSA-N
Formula
C17H11ClN2O4
Mass
342.74
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
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
Chloroquinolines Benzoic acid esters Nitrobenzenes Nitrotoluenes Nitroaromatic compounds Benzoyl derivatives Aryl chlorides Pyridines and derivatives Heteroaromatic compounds Carboxylic acid esters Organic oxoazanium compounds Azacyclic compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzoate - Haloquinoline - Chloroquinoline - Benzoate ester - Quinoline - Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Benzoyl - Toluene - Aryl chloride - Aryl halide - Pyridine - Heteroaromatic compound - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Monocarboxylic acid or derivatives - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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