Compound Identification
SMILES
COC1=C(OCC2=CC=C(C=C2)[N+]([O-])=O)C(=O)O\C1=C/CCl
InChIKey
InChIKey=IQVVCNLUMYPNIW-WDZFZDKYSA-N
Formula
C14H12ClNO6
Mass
325.7
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
Nitroaromatic compounds Butenolides Vinylogous esters Enoate esters Enol esters Lactones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Alkyl chlorides Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Carbonyl compounds Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - 2-furanone - Dihydrofuran - Enol ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Organic nitro compound - Carboxylic acid ester - Lactone - C-nitro compound - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl chloride - Organic nitrogen compound - Organic salt - Carbonyl group - Organic cation - Aromatic heteromonocyclic 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