(2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(3-fluoro-4-methylphenyl)-2-(4-methyl-1-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(3-fluoro-4-methylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)propionamide Formula: C16H24FN2O+ MolecularWeight: 279.372963

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C)C(=O)NC2=CC(=C(C=C2)C)F

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](C)C(=O)NC2=CC(=C(C=C2)C)F

InChI

InChI=1S/C16H23FN2O/c1-11-6-8-19(9-7-11)13(3)16(20)18-14-5-4-12(2)15(17)10-14/h4-5,10-11,13H,6-9H2,1-3H3,(H,18,20)/p+1/t13-/m0/s1