Structure Information
Structure

Compound Identification

SMILES

CC1=NN(C(=O)C1N=NC1=C(C=CC(NC2=NC(NC3=CC=CC=C3C)=NC(F)=N2)=C1)S(O)(=O)=O)C1=CC(=C2C=CC=C(C2=C1)S(O)(=O)=O)S(O)(=O)=O

InChIKey

InChIKey=WOIDAJKHLTVIQX-UHFFFAOYSA-N

Formula

C30H24FN9O10S3

Mass

785.75

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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 - Alpha-amino acid or derivatives - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Aniline or substituted anilines - 2,4-diamine-s-triazine - Toluene - Halo-s-triazine - Aminotriazine - Amino-1,3,5-triazine - Monocyclic benzene moiety - Aryl fluoride - 1,3,5-triazine - Aryl halide - Pyrazolinone - Triazine - Pyrazoline - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Azo compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Carboxylic acid derivative - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur 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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