Compound Identification
SMILES
CCOC1=C(OC(=O)C2=CC=CC3=CC=CC=C23)C(Br)=CC(C=C(C#N)C(=O)NC2=CC=CC=C2[N+]([O-])=O)=C1
InChIKey
InChIKey=OCBMCTZTLZZILG-UHFFFAOYSA-N
Formula
C29H20BrN3O6
Mass
586.398
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalenecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenecarboxylic acids and derivatives
Alternative Parents
Cinnamic acid amides Phenol esters Anilides Nitrobenzenes Phenoxy compounds Phenol ethers N-arylamides Nitroaromatic compounds Alkyl aryl ethers Bromobenzenes Aryl bromides Secondary carboxylic acid amides Carboxylic acid esters Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Nitriles Hydrocarbon derivatives Organic salts Carbonyl compounds Organic zwitterions Organobromides Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
1-naphthalenecarboxylic acid or derivatives - Cinnamic acid amide - Cinnamic acid or derivatives - Phenol ester - Nitrobenzene - Anilide - Phenoxy compound - Nitroaromatic compound - N-arylamide - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Carbonitrile - Nitrile - Organic oxoazanium - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organic zwitterion - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organobromide - Organohalogen compound - Organic salt - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids and derivatives. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group or a derivative at one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available