Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=CC(NC2=NC(NC3=CC(C)=C(C=C3)N=NC3=CC(=C4C=CC=C(C4=C3)S(O)(=O)=O)S(O)(=O)=O)=NC(NCCO)=N2)=C1)N=NC1=CC(=C2C=CC=C(C2=C1)S(O)(=O)=O)S(O)(=O)=O

InChIKey

InChIKey=UHLVINFHJXUXCW-UHFFFAOYSA-N

Formula

C39H34N10O13S4

Mass

979.0

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Naphthalene sulfonates

Direct Parent

1-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Aniline or substituted anilines - Amino-1,3,5-triazine - Aminotriazine - Toluene - N-aliphatic s-triazine - Monocyclic benzene moiety - Triazine - 1,3,5-triazine - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azo compound - Organic 1,3-dipolar compound - Azacycle - Alkanolamine - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Amine - Organooxygen compound - Organonitrogen compound - Alcohol - Organosulfur compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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