N-[(2R)-2-phenyl-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]propyl]benzenesulfonamide

Systemtic Name: N-[(2R)-2-phenyl-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]propyl]benzenesulfonamide Openeye Name: N-[(2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-2-phenyl-propyl]benzenesulfonamide CAS Name: N-[(2R)-2-phenyl-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]propyl]benzenesulfonamide IUPAC Name: N-[(2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-2-phenylpropyl]benzenesulfonamide Traditional Name: N-[(2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-2-phenyl-propyl]benzenesulfonamide Formula: C26H33N3O2S+2 MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=CC=C1)(C2=CC=CC=C2)[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C[C@](CNS(=O)(=O)C1=CC=CC=C1)(C2=CC=CC=C2)[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2S/c1-26(24-13-7-3-8-14-24,22-27-32(30,31)25-15-9-4-10-16-25)29-19-17-28(18-20-29)21-23-11-5-2-6-12-23/h2-16,27H,17-22H2,1H3/p+2/t26-/m0/s1