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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
Nitrobenzenes Nitroaromatic compounds 1,2,4-triazines Pyrroles Furans Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Hydrazones Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organooxygen compounds Organopnictogen compounds
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