N-cyclohexyl-N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-cyclohexyl-N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-cyclohexyl-4-methyl-benzenesulfonamide CAS Name: N-cyclohexyl-N-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-cyclohexyl-4-methylbenzenesulfonamide Traditional Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethyl]-N-cyclohexyl-4-methyl-benzenesulfonamide Formula: C32H40N3O3S+ MolecularWeight: 546.7433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C32H39N3O3S/c1-26-17-19-30(20-18-26)39(37,38)35(29-15-9-4-10-16-29)25-31(36)33-21-23-34(24-22-33)32(27-11-5-2-6-12-27)28-13-7-3-8-14-28/h2-3,5-8,11-14,17-20,29,32H,4,9-10,15-16,21-25H2,1H3/p+1