Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=NC(=C(NC(C)(C)CC(C)(C)C)N2C=C1)C1=CC=CC=C1OS(=O)(=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=DJOKVIPDLLKWGF-UHFFFAOYSA-N

Formula

C28H32N4O5S

Mass

536.65

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

p-Nitrobenzenesulfonates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

P-nitrobenzenesulfonate - P-bromobenzenesulfonate - 4-phenylimidazole - 5-phenylimidazole - Benzenesulfonate ester - Arylsulfonic acid or derivatives - Nitrobenzene - Benzenesulfonyl group - Imidazo[1,2-a]pyridine - Imidazopyridine - Phenoxy compound - Nitroaromatic compound - Methylpyridine - Aminoimidazole - N-substituted imidazole - Organosulfonic acid ester - Pyridine - Azole - Imidazole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organic nitrogen compound - Organosulfur compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as p-nitrobenzenesulfonates. These are benzenesulfonic acids (or derivative thereof) carrying a nitro group at the para- position.

External Descriptors

Not available

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