Compound Identification
SMILES
COC(=O)C1=C(C)NC2=C(OC(=O)OC3=CC=C(C=C3)[N+]([O-])=O)C=C3N(C[C@@H](CBr)C3=C12)C(=O)\C=C\C1=CC(N(C)C)=C(OC)C=C1
InChIKey
InChIKey=GEAYFIIGQIVWSZ-NBSXQYNISA-N
Formula
C33H31BrN4O9
Mass
707.534
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Pyrroloindoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyrroloindoles
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloindoles
Alternative Parents
Cinnamic acids and derivatives Indolecarboxylic acids and derivatives Indoles Methoxyanilines Nitrobenzenes Aminophenyl ethers Dialkylarylamines Styrenes Methoxybenzenes Nitroaromatic compounds Pyrrole carboxylic acids and derivatives Anisoles Phenoxy compounds Alkyl aryl ethers Carbonic acid diesters Substituted pyrroles Heteroaromatic compounds Methyl esters Vinylogous amides Tertiary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Alkyl bromides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Indolecarboxylic acid derivative - Pyrroloindole - Aminophenyl ether - Indole - Nitrobenzene - Methoxyaniline - Anisole - Phenoxy compound - Nitroaromatic compound - Phenol ether - Pyrrole-3-carboxylic acid or derivatives - Styrene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Substituted pyrrole - Benzenoid - Carbonic acid diester - Monocyclic benzene moiety - Pyrrole - Vinylogous amide - Heteroaromatic compound - Methyl ester - Tertiary carboxylic acid amide - C-nitro compound - Carbonic acid derivative - Carboxylic acid ester - Organic nitro compound - Carboxamide group - Tertiary amine - Amino acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Ether - Organic oxoazanium - Organic zwitterion - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic salt - Organic oxide - Alkyl bromide - Alkyl halide - Organonitrogen compound - Organic oxygen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloindoles. These are compounds containing a pyrroloindole moiety, which is a tricyclic heterocycle which consists of a pyrrole ring fused to an indole. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Indole is a bicyclic compound consisting of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors
Not available