Compound Identification
SMILES
OCCNC1=NC(Cl)=NC(NC2=C3C(=O)\C(=N\NC4=CC=CC=C4S(O)(=O)=O)C(=CC3=C(C=C2)S(O)(=O)=O)S(O)(=O)=O)=N1
InChIKey
InChIKey=XWYGUDDYJREAHJ-STBIYBPSSA-N
Formula
C21H18ClN7O11S3
Mass
676.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenes
Alternative Parents
Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds 1,3,5-triazine-2,4-diamines Phenylhydrazines Aryl ketones Secondary alkylarylamines N-aliphatic s-triazines Chloro-s-triazines Aryl chlorides Vinylogous amides Sulfonyls Organosulfonic acids Heteroaromatic compounds Alkanolamines Azacyclic compounds Hydrazones Organic oxides Hydrocarbon derivatives Organochlorides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzenesulfonate - Naphthalene - Benzenesulfonyl group - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - 2,4-diamine-s-triazine - Phenylhydrazine - Aryl ketone - Amino-1,3,5-triazine - Chloro-s-triazine - Halo-s-triazine - Aminotriazine - Secondary aliphatic/aromatic amine - N-aliphatic s-triazine - 1,3,5-triazine - Monocyclic benzene moiety - Aryl halide - Triazine - Aryl chloride - Heteroaromatic compound - Vinylogous amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Ketone - Alkanolamine - Secondary amine - Azacycle - Hydrazone - Organoheterocyclic compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Primary alcohol - Amine - Organosulfur compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
External Descriptors
Not available