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

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-4-nitro-benzenesulfonamide Openeye Name: N-(2-cyclohexylsulfanylethyl)-4-nitro-benzenesulfonamide CAS Name: N-[2-(cyclohexylthio)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-(2-cyclohexylsulfanylethyl)-4-nitrobenzenesulfonamide Traditional Name: N-[2-(cyclohexylthio)ethyl]-4-nitro-benzenesulfonamide Formula: C14H20N2O4S2 MolecularWeight: 344.4496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O4S2/c17-16(18)12-6-8-14(9-7-12)22(19,20)15-10-11-21-13-4-2-1-3-5-13/h6-9,13,15H,1-5,10-11H2