2-(4-phenethylpiperidin-1-ium-1-yl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-phenethylpiperidin-1-ium-1-yl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(4-phenethylpiperidin-1-ium-1-yl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(4-phenethyl-1-piperidin-1-iumyl)-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-phenethylpiperidin-1-ium-1-yl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(4-phenethylpiperidin-1-ium-1-yl)-1-(4-pyridin-1-ium-2-ylpiperazino)ethanone Formula: C24H34N4O+2 MolecularWeight: 394.55296

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC2=CC=CC=C2)CC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1C[NH+](CCC1CCC2=CC=CC=C2)CC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C24H32N4O/c29-24(28-18-16-27(17-19-28)23-8-4-5-13-25-23)20-26-14-11-22(12-15-26)10-9-21-6-2-1-3-7-21/h1-8,13,22H,9-12,14-20H2/p+2