(2S)-N-(3-fluorophenyl)-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(3-fluorophenyl)-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(3-fluorophenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-(3-fluorophenyl)-2-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(3-fluorophenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(3-fluorophenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]propionamide Formula: C19H27FN3O2+ MolecularWeight: 348.434983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)F)[NH+]2CCC(CC2)C(=O)N3CCCC3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)F)[NH+]2CCC(CC2)C(=O)N3CCCC3

InChI

InChI=1S/C19H26FN3O2/c1-14(18(24)21-17-6-4-5-16(20)13-17)22-11-7-15(8-12-22)19(25)23-9-2-3-10-23/h4-6,13-15H,2-3,7-12H2,1H3,(H,21,24)/p+1/t14-/m0/s1