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

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-N-(2-methoxyphenyl)benzenesulfonamide Openeye Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-(2-methoxyphenyl)benzenesulfonamide CAS Name: N-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-N-(2-methoxyphenyl)benzenesulfonamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-(2-methoxyphenyl)benzenesulfonamide Traditional Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethyl]-N-(2-methoxyphenyl)benzenesulfonamide Formula: C32H34N3O4S+ MolecularWeight: 556.69506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H33N3O4S/c1-39-30-20-12-11-19-29(30)35(40(37,38)28-17-9-4-10-18-28)25-31(36)33-21-23-34(24-22-33)32(26-13-5-2-6-14-26)27-15-7-3-8-16-27/h2-20,32H,21-25H2,1H3/p+1