piperazin-4-ium-1-yl-[(3S)-1-pyridin-3-ylcarbonylpiperidin-3-yl]methanone

Systemtic Name: piperazin-4-ium-1-yl-[(3S)-1-pyridin-3-ylcarbonylpiperidin-3-yl]methanone Openeye Name: piperazin-4-ium-1-yl-[(3S)-1-(pyridine-3-carbonyl)-3-piperidyl]methanone CAS Name: [(3S)-1-[oxo(3-pyridinyl)methyl]-3-piperidinyl]-(1-piperazin-4-iumyl)methanone IUPAC Name: piperazin-4-ium-1-yl-[(3S)-1-(pyridine-3-carbonyl)piperidin-3-yl]methanone Traditional Name: [(3S)-1-nicotinoyl-3-piperidyl]-piperazin-4-ium-1-yl-methanone Formula: C16H23N4O2+ MolecularWeight: 303.37942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CN=CC=C2)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CN=CC=C2)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C16H22N4O2/c21-15(13-3-1-5-18-11-13)20-8-2-4-14(12-20)16(22)19-9-6-17-7-10-19/h1,3,5,11,14,17H,2,4,6-10,12H2/p+1/t14-/m0/s1