Compound Identification
SMILES
COC1=C(OC)C=C(C(=C1)C(=O)OCC(=O)C1=CC=CN1)[N+]([O-])=O
InChIKey
InChIKey=IQBQIGAXEYNBOJ-UHFFFAOYSA-N
Formula
C15H14N2O7
Mass
334.284
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
M-methoxybenzoic acids and derivatives P-methoxybenzoic acids and derivatives Nitrophenyl ethers Benzoic acid esters Dimethoxybenzenes Methoxyanilines Anisoles Aryl alkyl ketones Benzoyl derivatives Phenoxy compounds Nitroaromatic compounds Alkyl aryl ethers Substituted pyrroles Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzoate - P-methoxybenzoic acid or derivatives - Nitrophenyl ether - M-methoxybenzoic acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Benzoate ester - Nitrobenzene - Methoxyaniline - Nitroaromatic compound - Methoxybenzene - Phenoxy compound - Aryl alkyl ketone - Aryl ketone - Benzoyl - Phenol ether - Anisole - Alkyl aryl ether - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxylic acid ester - Ketone - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Azacycle - Organic zwitterion - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic salt - Aromatic heteromonocyclic 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