N-(1,2-oxazol-3-ylmethyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide

Systemtic Name: N-(1,2-oxazol-3-ylmethyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide Openeye Name: N-(isoxazol-3-ylmethyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide CAS Name: N-(3-isoxazolylmethyl)-1-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: N-(1,2-oxazol-3-ylmethyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide Traditional Name: N-(isoxazol-3-ylmethyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]isonipecotamide Formula: C24H35N4O2+ MolecularWeight: 411.5603

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCC3=NOC=C3)CCCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCC3=NOC=C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C24H34N4O2/c29-24(25-19-22-12-18-30-26-22)21-8-16-28(17-9-21)23-10-14-27(15-11-23)13-4-7-20-5-2-1-3-6-20/h1-3,5-6,12,18,21,23H,4,7-11,13-17,19H2,(H,25,29)/p+1