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

Systemtic Name: 2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-1-(4-benzyl-1-piperidyl)ethanone CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-1-(4-benzylpiperidin-1-yl)ethanone Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-1-(4-benzylpiperidino)ethanone Formula: C26H34N3O2+ MolecularWeight: 420.56706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O2/c1-21(30)24-7-9-25(10-8-24)28-17-15-27(16-18-28)20-26(31)29-13-11-23(12-14-29)19-22-5-3-2-4-6-22/h2-10,23H,11-20H2,1H3/p+1