2-phenyl-1-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-phenyl-1-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-phenyl-1-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-phenyl-1-[4-(2-pyridinylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-phenyl-1-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-phenyl-1-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]ethanone Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O/c22-18(14-16-6-2-1-3-7-16)21-12-10-20(11-13-21)15-17-8-4-5-9-19-17/h1-9H,10-15H2/p+1