(3S)-1-(1-cyclopropylcarbonylpiperidin-4-yl)-N-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-cyclopropylcarbonylpiperidin-4-yl)-N-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-N-[2-(2-fluorophenyl)ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-carboxamide Formula: C23H33FN3O2+ MolecularWeight: 402.525423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CCN(CC2)C(=O)C3CC3)C(=O)NCCC4=CC=CC=C4F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CCN(CC2)C(=O)C3CC3)C(=O)NCCC4=CC=CC=C4F

InChI

InChI=1S/C23H32FN3O2/c24-21-6-2-1-4-17(21)9-12-25-22(28)19-5-3-13-27(16-19)20-10-14-26(15-11-20)23(29)18-7-8-18/h1-2,4,6,18-20H,3,5,7-16H2,(H,25,28)/p+1/t19-/m0/s1