Structure Information
Structure

Compound Identification

SMILES

CC1(C)\C(=C/C=C/C2=[N+](CCCCS(O)(=O)=O)C3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)NCCCCCCO[P+](N)(O)O)C2(C)C)N(CCCCS(O)(=O)=O)C2=C1C1=C(C=C2)C(=CC=C1)S(O)(=O)=O

InChIKey

InChIKey=RCOTUGPZEHXZGF-UHFFFAOYSA-P

Formula

C45H61N4O14PS4

Mass

1041.21

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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 sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - 3-alkylindole - Arylsulfonic acid or derivatives - Indole or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Tertiary aliphatic/aromatic amine - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Aminosulfonyl compound - Alkanesulfonic acid - Tertiary amine - Enamine - Azacycle - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Amine - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic cation - 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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