Structure Information
Structure

Compound Identification

SMILES

COC1=C(OS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C=CC(=C1)C1=C(NC2CCCCC2)N2C=C(Br)C=CC2=N1

InChIKey

InChIKey=ZYFQMOMJQQOJRC-UHFFFAOYSA-N

Formula

C30H28BrN3O4S

Mass

606.54

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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 sulfonic acid or derivatives - 2-naphthalene sulfonate - 5-phenylimidazole - 4-phenylimidazole - Arylsulfonic acid or derivatives - Imidazopyridine - Imidazo[1,2-a]pyridine - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - N-substituted imidazole - Monocyclic benzene moiety - Organosulfonic acid ester - Aryl halide - Aryl bromide - Pyridine - Aminoimidazole - Imidazole - Sulfonyl - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Azacycle - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organohalogen compound - Organobromide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - 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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