Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=IXLCFZWZPQLKIX-UHFFFAOYSA-N

Formula

C37H29N11O13S4

Mass

963.94

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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 - N-phenylurea - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Aniline or substituted anilines - Amino-1,3,5-triazine - Aminotriazine - Toluene - Triazinone - Triazine - Monocyclic benzene moiety - 1,3,5-triazine - Organosulfonic acid or derivatives - Heteroaromatic compound - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Sulfinic acid - Urea - Azo compound - Sulfinic acid derivative - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - 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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