Compound Identification
SMILES
NCc1cccc2C3=NC(=NCNC(N=C4N=C(N=C5NC(=N3)c3cccc(CC6C(=O)c7ccccc7C6=O)c53)c3cccc(c43)S(O)(=O)=O)=C3CC=CC=C3)c12
InChIKey
InChIKey=XYRIVFBDIXAKSN-UHFFFAOYSA-N
Formula
C43H31N9O5S
Mass
785.84
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Indanes
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Subclass
Indanones
- Level 5 Indanediones
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Subclass
Indanones
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Class
Indanes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Indanones
Intermediate Tree Nodes
Not available
Direct Parent
Indanediones
Alternative Parents
Isoindoles 1-sulfo,2-unsubstituted aromatic compounds Aryl alkyl ketones Beta-diketones Aralkylamines Imidolactams Sulfonyls Pyrroles Organosulfonic acids Heteroaromatic compounds Ketene acetals Propargyl-type 1,3-dipolar organic compounds Dialkylamines Azacyclic compounds Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indanedione - 1-sulfo,2-unsubstituted aromatic compound - Isoindole or derivatives - Isoindole - Arylsulfonic acid or derivatives - Aryl alkyl ketone - Aryl ketone - 1,3-diketone - Aralkylamine - Imidolactam - 1,3-dicarbonyl compound - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Ketone - Ketene acetal or derivatives - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanediones. These are compounds containing an indane ring bearing two ketone groups.
External Descriptors
Not available