1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-2-[4-(2-pyridinylmethyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]ethanone Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C23H28N4O/c28-23(27-12-9-21(10-13-27)20-6-2-1-3-7-20)19-26-16-14-25(15-17-26)18-22-8-4-5-11-24-22/h1-9,11H,10,12-19H2/p+1