N-(2-cyclopentylsulfanylethyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(2-cyclopentylsulfanylethyl)-4-nitro-benzenesulfonamide Openeye Name: N-(2-cyclopentylsulfanylethyl)-4-nitro-benzenesulfonamide CAS Name: N-[2-(cyclopentylthio)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-(2-cyclopentylsulfanylethyl)-4-nitrobenzenesulfonamide Traditional Name: N-[2-(cyclopentylthio)ethyl]-4-nitro-benzenesulfonamide Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O4S2/c16-15(17)11-5-7-13(8-6-11)21(18,19)14-9-10-20-12-3-1-2-4-12/h5-8,12,14H,1-4,9-10H2