1-(1-cycloheptylpiperidin-1-ium-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(1-cycloheptylpiperidin-1-ium-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(1-cycloheptylpiperidin-1-ium-4-yl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(1-cycloheptyl-4-piperidin-1-iumyl)-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(1-cycloheptylpiperidin-1-ium-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(1-cycloheptylpiperidin-1-ium-4-yl)-N-(3-pyridylmethyl)isonipecotamide Formula: C24H39N4O+ MolecularWeight: 399.59266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CCC(CC2)N3CCC(CC3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCCC(CC1)[NH+]2CCC(CC2)N3CCC(CC3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C24H38N4O/c29-24(26-19-20-6-5-13-25-18-20)21-9-14-27(15-10-21)23-11-16-28(17-12-23)22-7-3-1-2-4-8-22/h5-6,13,18,21-23H,1-4,7-12,14-17,19H2,(H,26,29)/p+1