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

Systemtic Name: (3S)-1-(1-cyclopropylcarbonylpiperidin-4-yl)-N-[(4-fluorophenyl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-[(4-fluorophenyl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-N-[(4-fluorophenyl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[(4-fluorophenyl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-(4-fluorobenzyl)piperidin-1-ium-3-carboxamide Formula: C22H31FN3O2+ MolecularWeight: 388.498843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CCN(CC2)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CCN(CC2)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H30FN3O2/c23-19-7-3-16(4-8-19)14-24-21(27)18-2-1-11-26(15-18)20-9-12-25(13-10-20)22(28)17-5-6-17/h3-4,7-8,17-18,20H,1-2,5-6,9-15H2,(H,24,27)/p+1/t18-/m0/s1