[(3S)-3-methylpiperidin-1-yl]-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]methanone

Systemtic Name: [(3S)-3-methylpiperidin-1-yl]-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]methanone Openeye Name: [(3S)-3-methyl-1-piperidyl]-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]methanone CAS Name: [(3S)-3-methyl-1-piperidinyl]-[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]methanone IUPAC Name: [(3S)-3-methylpiperidin-1-yl]-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]methanone Traditional Name: [(3S)-3-methylpiperidino]-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]methanone Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C18H27N3O/c1-15-5-4-10-21(13-15)18(22)16-7-11-20(12-8-16)14-17-6-2-3-9-19-17/h2-3,6,9,15-16H,4-5,7-8,10-14H2,1H3/p+1/t15-/m0/s1