3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide

Systemtic Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide Openeye Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide CAS Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]-3-piperidin-1-iumyl]-N-(2-fluorophenyl)propanamide IUPAC Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide Traditional Name: 3-[(3R)-1-(4-acetamidobenzyl)piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propionamide Formula: C23H29FN3O2+ MolecularWeight: 398.493663

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCCC(C2)CCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCC[C@@H](C2)CCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C23H28FN3O2/c1-17(28)25-20-11-8-19(9-12-20)16-27-14-4-5-18(15-27)10-13-23(29)26-22-7-3-2-6-21(22)24/h2-3,6-9,11-12,18H,4-5,10,13-16H2,1H3,(H,25,28)(H,26,29)/p+1/t18-/m1/s1