Compound Identification
SMILES
COC1=CC=CC=C1NC1=CC(=C(N)C2=C1C(=O)C1=CC=CC=C1C2=O)S(O)(=O)=O
InChIKey
InChIKey=WCRXWKFBJBYISN-UHFFFAOYSA-N
Formula
C21H16N2O6S
Mass
424.43
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
Methoxyanilines Aminophenyl ethers 1-sulfo,2-unsubstituted aromatic compounds Phenoxy compounds Methoxybenzenes Aryl ketones Anisoles Alkyl aryl ethers Primary aromatic amines Vinylogous amides Sulfonyls Organosulfonic acids Secondary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
9,10-anthraquinone - Anthraquinone - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Aminophenyl ether - Methoxyaniline - Phenol ether - Phenoxy compound - Aryl ketone - Aniline or substituted anilines - Anisole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Primary aromatic amine - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Vinylogous amide - Organic sulfonic acid or derivatives - Ketone - Secondary amine - Ether - Organosulfur compound - Amine - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic homopolycyclic 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