Compound Identification
SMILES
C[C@H](OC(=O)C1=CC=C(S1)[N+]([O-])=O)C(=O)N1CCC2=CC=CC=C12
InChIKey
InChIKey=UARQXYQHUJVKRL-JTQLQIEISA-N
Formula
C16H14N2O5S
Mass
346.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indoles and derivatives
Alternative Parents
2-nitrothiophenes Thiophene carboxylic acids and derivatives Nitroaromatic compounds 2,5-disubstituted thiophenes Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole or derivatives - 2-nitrothiophene - Nitrothiophene - Nitroaromatic compound - Thiophene carboxylic acid or derivatives - 2,5-disubstituted thiophene - Benzenoid - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxamide group - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles and derivatives. These are organic compounds containing an indole, which is a bicyclic ring system made up of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors
Not available