2-phenyl-1-[4-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]piperidin-1-yl]ethanone

Systemtic Name: 2-phenyl-1-[4-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]piperidin-1-yl]ethanone Openeye Name: 1-[4-(4-benzylpiperazine-1,4-diium-1-yl)-1-piperidyl]-2-phenyl-ethanone CAS Name: 2-phenyl-1-[4-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-(4-benzylpiperazine-1,4-diium-1-yl)piperidin-1-yl]-2-phenylethanone Traditional Name: 1-[4-(4-benzylpiperazine-1,4-diium-1-yl)piperidino]-2-phenyl-ethanone Formula: C24H33N3O+2 MolecularWeight: 379.53832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H31N3O/c28-24(19-21-7-3-1-4-8-21)27-13-11-23(12-14-27)26-17-15-25(16-18-26)20-22-9-5-2-6-10-22/h1-10,23H,11-20H2/p+2