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

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-N-(4-ethoxyphenyl)benzenesulfonamide Openeye Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-(4-ethoxyphenyl)benzenesulfonamide CAS Name: N-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-N-(4-ethoxyphenyl)benzenesulfonamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-(4-ethoxyphenyl)benzenesulfonamide Traditional Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethyl]-N-p-phenetyl-benzenesulfonamide Formula: C33H36N3O4S+ MolecularWeight: 570.72164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C33H35N3O4S/c1-2-40-30-20-18-29(19-21-30)36(41(38,39)31-16-10-5-11-17-31)26-32(37)34-22-24-35(25-23-34)33(27-12-6-3-7-13-27)28-14-8-4-9-15-28/h3-21,33H,2,22-26H2,1H3/p+1