N-(1-ethynylcyclohexyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(1-ethynylcyclohexyl)-4-nitro-benzenesulfonamide Openeye Name: N-(1-ethynylcyclohexyl)-4-nitro-benzenesulfonamide CAS Name: N-(1-ethynylcyclohexyl)-4-nitrobenzenesulfonamide IUPAC Name: N-(1-ethynylcyclohexyl)-4-nitrobenzenesulfonamide Traditional Name: N-(1-ethynylcyclohexyl)-4-nitro-benzenesulfonamide Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C#CC1(CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O4S/c1-2-14(10-4-3-5-11-14)15-21(19,20)13-8-6-12(7-9-13)16(17)18/h1,6-9,15H,3-5,10-11H2