Compound Identification
SMILES
[O-][N+](=O)C1=CC2=C(C(CCl)CN2C(=O)C(F)(F)F)C2=CC=CC(C#N)=C12
InChIKey
InChIKey=IBFVJLKIJXNWQX-UHFFFAOYSA-N
Formula
C16H9ClF3N3O3
Mass
383.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Nitronaphthalenes
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Nitronaphthalenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitronaphthalenes
Alternative Parents
Indoles and derivatives Nitroaromatic compounds Tertiary carboxylic acid amides Tertiary amines Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Nitriles Alkyl chlorides Organic oxides Organic salts Hydrocarbon derivatives Carbonyl compounds Organochlorides Organofluorides Alkyl fluorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-nitronaphthalene - Indole or derivatives - Nitroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - C-nitro compound - Tertiary amine - Organic nitro compound - Carboxylic acid derivative - Carbonitrile - Nitrile - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic salt - Alkyl chloride - Organofluoride - Organochloride - Amine - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl fluoride - Cyanide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups.
External Descriptors
Not available