Compound Identification
SMILES
COCCOC(=O)C1=C(C)N(CCNC2=CC=C(C=C2)[N+]([O-])=O)C2=C1C=C(O)C=C2
InChIKey
InChIKey=ZAYSHKRRZPAGEX-UHFFFAOYSA-N
Formula
C21H23N3O6
Mass
413.43
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
Indolecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolecarboxylic acids and derivatives
Alternative Parents
N-alkylindoles Hydroxyindoles Nitrobenzenes Indoles Pyrrole carboxylic acids and derivatives Phenylalkylamines Aniline and substituted anilines Nitroaromatic compounds Secondary alkylarylamines 1-hydroxy-2-unsubstituted benzenoids Substituted pyrroles Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Dialkyl ethers Organic salts Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - N-alkylindole - Hydroxyindole - Indole - Nitrobenzene - Nitroaromatic compound - Pyrrole-3-carboxylic acid or derivatives - Phenylalkylamine - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Pyrrole - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Secondary amine - Carboxylic acid derivative - Organic oxoazanium - Dialkyl ether - Ether - Organic salt - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.
External Descriptors
Not available