Structure Information
Structure

Compound Identification

SMILES

CC1=C(C)C2=C(C3=CC(C)=C(OS(=O)(=O)C4=CC(O)=C(C=C4)C(=O)OC(C)(C)C)C(C)=C3)C3=CC=CC=C3C(Br)=C2S1

InChIKey

InChIKey=KUVDDYAYVJBOEE-UHFFFAOYSA-N

Formula

C33H31BrO6S2

Mass

667.63

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Hydroxybenzoic acid derivatives - Salicylic acid and derivatives

Direct Parent

Sulfosalicylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Naphthothiophene - Sulfosalicylic acid or derivatives - O-hydroxybenzoic acid ester - Benzenesulfonate ester - Benzoate ester - Naphthalene - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzothiophene - 1-benzothiophene - Benzenesulfonyl group - Phenoxy compound - Benzoyl - M-xylene - Xylene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aryl halide - Aryl bromide - Organosulfonic acid ester - Heteroaromatic compound - Vinylogous acid - Thiophene - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as sulfosalicylic acids and derivatives. These are salicylic acids (or derivatives thereof) with a sulfate group attached to the benzene ring.

External Descriptors

Not available

Previous Back Next