Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(NC3=C2N=NC(N\N=C/C2=CC=C(O2)C2=CC(=CC=C2)[N+]([O-])=O)=N3)C=C1

InChIKey

InChIKey=SMWRZZCKCGVHCW-JJFYIABZSA-N

Formula

C21H15N7O3

Mass

413.397

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indoles

Intermediate Tree Nodes

Not available

Direct Parent

Indoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Triazine - 1,2,4-triazine - Benzenoid - Furan - Heteroaromatic compound - Pyrrole - C-nitro compound - Organic nitro compound - Hydrazone - Organic oxoazanium - Oxacycle - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic salt - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.

External Descriptors

Not available

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