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

Systemtic Name: (2S)-N-(4-fluorophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2S)-N-(4-fluorophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2S)-N-(4-fluorophenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-2-phenylacetamide IUPAC Name: (2S)-N-(4-fluorophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2S)-N-(4-fluorophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-acetamide Formula: C20H24FN2O+ MolecularWeight: 327.415763

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H23FN2O/c1-15-6-5-13-23(14-15)19(16-7-3-2-4-8-16)20(24)22-18-11-9-17(21)10-12-18/h2-4,7-12,15,19H,5-6,13-14H2,1H3,(H,22,24)/p+1/t15-,19-/m0/s1