(2S)-N-[4-(3-fluorophenyl)phenyl]-1-(1-methylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[4-(3-fluorophenyl)phenyl]-1-(1-methylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[4-(3-fluorophenyl)phenyl]-1-(1-methylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[4-(3-fluorophenyl)phenyl]-1-(1-methyl-4-piperidin-1-iumyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[4-(3-fluorophenyl)phenyl]-1-(1-methylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[4-(3-fluorophenyl)phenyl]-1-(1-methylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Formula: C23H29FN3O+ MolecularWeight: 382.494263

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCCC2C(=O)NC3=CC=C(C=C3)C4=CC(=CC=C4)F

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC[C@H]2C(=O)NC3=CC=C(C=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C23H28FN3O/c1-26-14-11-21(12-15-26)27-13-3-6-22(27)23(28)25-20-9-7-17(8-10-20)18-4-2-5-19(24)16-18/h2,4-5,7-10,16,21-22H,3,6,11-15H2,1H3,(H,25,28)/p+1/t22-/m0/s1