Compound Identification
SMILES
NC1=C(C=CC(NCCO)=C1)N=NC1=CC2=C(C=C1)C=C(\C(=N/NC1=CC=C(NC3=C(C=C(N\N=C4\C(=O)C5=C(C=CC(=C5)N=NC5=C(N)C=C(NCCO)C=C5)C=C4S(O)(=O)=O)C=C3)S(O)(=O)=O)C=C1)C2=O)S(O)(=O)=O
InChIKey
InChIKey=NKUPJSNHCNDCAO-AITQHXARSA-N
Formula
C48H43N13O13S3
Mass
1106.13
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 Phenylhydrazines Phenylalkylamines Aniline and substituted anilines Aryl ketones Secondary alkylarylamines Primary aromatic amines Sulfonyls Organosulfonic acids 1,2-aminoalcohols Azo compounds Propargyl-type 1,3-dipolar organic compounds Hydrazones Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Naphthalene - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Phenylhydrazine - Phenylalkylamine - Aniline or substituted anilines - Aryl ketone - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Primary aromatic amine - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - 1,2-aminoalcohol - Azo compound - Ketone - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrazone - Alkanolamine - Primary amine - Organonitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Amine - Hydrocarbon derivative - Primary alcohol - Aromatic homopolycyclic 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