Compound Identification
SMILES
CC1=CC(=O)C2=C(C(C3=CCC4C(C3C2)C(=O)N(CC2=CC=CS2)C4=O)C2=C(Cl)C=C(O)C=C2)C1=O
InChIKey
InChIKey=NHVVDBNMNGPFIY-UHFFFAOYSA-N
Formula
C28H22ClNO5S
Mass
520.0
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Anthracenes
- Subclass Anthraquinones
-
Class
Anthracenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Anthracenes
Subclass
Anthraquinones
Intermediate Tree Nodes
Not available
Direct Parent
Anthraquinones
Alternative Parents
Isoindolones Isoindoles M-chlorophenols 1-hydroxy-2-unsubstituted benzenoids Chlorobenzenes Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides N-alkylpyrrolidines Thiophenes Dicarboximides Heteroaromatic compounds Lactams Ketones Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthraquinone - 1,4-anthraquinone - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - 3-halophenol - 3-chlorophenol - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Phenol - Monocyclic benzene moiety - Aryl halide - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Aryl chloride - Dicarboximide - Carboxylic acid imide - Thiophene - Heteroaromatic compound - Pyrrolidine - Lactam - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone.
External Descriptors
Not available