Compound Identification
SMILES
COC1=C(OCC(=O)NC2=C(C=CC(C)=C2C)[N+]([O-])=O)C=CC(=C1)C#N
InChIKey
InChIKey=JEDPRHULRYFJDU-UHFFFAOYSA-N
Formula
C18H17N3O5
Mass
355.35
Taxonomic Classification
Taxonomy Tree
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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
Anilides Nitrotoluenes o-Xylenes Phenoxy compounds Anisoles Nitroaromatic compounds N-arylamides Methoxybenzenes Benzonitriles Alkyl aryl ethers Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Anilide - Nitrotoluene - Phenol ether - N-arylamide - Phenoxy compound - Nitroaromatic compound - Methoxybenzene - Xylene - O-xylene - Benzonitrile - Anisole - Alkyl aryl ether - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Nitrile - Carboxylic acid derivative - Organic oxoazanium - Carbonitrile - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Cyanide - Organic oxygen 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