N-cyclopropyl-N-[(1S)-1-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1S)-1-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide Openeye Name: N-cyclopropyl-N-[(1S)-1-[1-[(2-fluoro-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide CAS Name: N-cyclopropyl-N-[(1S)-1-[1-[(2-fluoro-4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-2-pyridinecarboxamide IUPAC Name: N-cyclopropyl-N-[(1S)-1-[1-[(2-fluoro-4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-2-phenylethyl]pyridine-2-carboxamide Traditional Name: N-cyclopropyl-N-[(1S)-1-[1-(2-fluoro-4-methoxy-benzyl)piperidin-1-ium-4-yl]-2-phenyl-ethyl]picolinamide Formula: C30H35FN3O2+ MolecularWeight: 488.616203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)C(CC3=CC=CC=C3)N(C4CC4)C(=O)C5=CC=CC=N5)F

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)[C@H](CC3=CC=CC=C3)N(C4CC4)C(=O)C5=CC=CC=N5)F

InChI

InChI=1S/C30H34FN3O2/c1-36-26-13-10-24(27(31)20-26)21-33-17-14-23(15-18-33)29(19-22-7-3-2-4-8-22)34(25-11-12-25)30(35)28-9-5-6-16-32-28/h2-10,13,16,20,23,25,29H,11-12,14-15,17-19,21H2,1H3/p+1/t29-/m0/s1