Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC(CC#CCS(=O)(=O)C1=CC=CC=C1)CN1C=CN=C1[N+]([O-])=O

InChIKey

InChIKey=IZFIMDQAYONVFI-UHFFFAOYSA-N

Formula

C17H17N3O6S

Mass

391.4

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonyl compounds

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonyl compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzenesulfonyl group - Nitroaromatic compound - N-substituted imidazole - Azole - Imidazole - Sulfone - Sulfonyl - Heteroaromatic compound - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.

External Descriptors

Not available

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