2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone CAS Name: 2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(4-benzylpiperidino)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O2/c1-30-24-9-7-23(8-10-24)27-17-15-26(16-18-27)20-25(29)28-13-11-22(12-14-28)19-21-5-3-2-4-6-21/h2-10,22H,11-20H2,1H3/p+1