Structure Information
Structure

Compound Identification

SMILES

CCN1C(\C=C\C=C\C=C\C=C2\N(CCCCCC(O)=O)C3=C(C4=CC(=CC(=C4C=C3)S(O)(=O)=O)S(O)(=O)=O)C2(C)CCOCCOCCOC)C(C)(CCCS(O)(=O)=O)C2=C1C=CC1=C(C=C(C=C21)S(O)(=O)=O)S(O)(=O)=O

InChIKey

InChIKey=MMOXPCPNQMGHTA-WVXIQAAOSA-N

Formula

C51H64N2O20S5

Mass

1185.37

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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

2-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-naphthalene sulfonate - 1-naphthalene sulfonate - 2-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonic acid or derivatives - Indolyl carboxylic acid derivative - Arylsulfonic acid or derivatives - Indole - Indole or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Medium-chain fatty acid - Amino fatty acid - Heterocyclic fatty acid - Aralkylamine - Fatty acyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Amino acid or derivatives - Tertiary amine - Amino acid - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Enamine - Ether - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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