1-(4-methylpiperidin-1-yl)-2-(2-piperazin-4-ium-1-ylphenyl)ethanone

Systemtic Name: 1-(4-methylpiperidin-1-yl)-2-(2-piperazin-4-ium-1-ylphenyl)ethanone Openeye Name: 1-(4-methyl-1-piperidyl)-2-(2-piperazin-4-ium-1-ylphenyl)ethanone CAS Name: 1-(4-methyl-1-piperidinyl)-2-[2-(1-piperazin-4-iumyl)phenyl]ethanone IUPAC Name: 1-(4-methylpiperidin-1-yl)-2-(2-piperazin-4-ium-1-ylphenyl)ethanone Traditional Name: 1-(4-methylpiperidino)-2-(2-piperazin-4-ium-1-ylphenyl)ethanone Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CC2=CC=CC=C2N3CC[NH2+]CC3

Isomeric SMILES

CC1CCN(CC1)C(=O)CC2=CC=CC=C2N3CC[NH2+]CC3

InChI

InChI=1S/C18H27N3O/c1-15-6-10-21(11-7-15)18(22)14-16-4-2-3-5-17(16)20-12-8-19-9-13-20/h2-5,15,19H,6-14H2,1H3/p+1