[4-(diphenylmethyl)piperazin-4-ium-1-yl]-[1-(phenylsulfonyl)piperidin-4-yl]methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-[1-(phenylsulfonyl)piperidin-4-yl]methanone Openeye Name: [1-(benzenesulfonyl)-4-piperidyl]-(4-benzhydrylpiperazin-4-ium-1-yl)methanone CAS Name: [1-(benzenesulfonyl)-4-piperidinyl]-[4-(diphenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [1-(benzenesulfonyl)piperidin-4-yl]-(4-benzhydrylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(1-besyl-4-piperidyl)methanone Formula: C29H34N3O3S+ MolecularWeight: 504.66356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H33N3O3S/c33-29(26-16-18-32(19-17-26)36(34,35)27-14-8-3-9-15-27)31-22-20-30(21-23-31)28(24-10-4-1-5-11-24)25-12-6-2-7-13-25/h1-15,26,28H,16-23H2/p+1