N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: N-methyl-1-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)isonipecotamide Formula: C27H39N4O+ MolecularWeight: 435.62476

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=CC=C1)C(=O)C2CCN(CC2)C3CC[NH+](CC3)CCCC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CN=CC=C1)C(=O)C2CCN(CC2)C3CC[NH+](CC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C27H38N4O/c1-29(22-24-9-5-15-28-21-24)27(32)25-11-19-31(20-12-25)26-13-17-30(18-14-26)16-6-10-23-7-3-2-4-8-23/h2-5,7-9,15,21,25-26H,6,10-14,16-20,22H2,1H3/p+1