(2S)-N-(2-chloranyl-4-fluoranyl-phenyl)-2-(4-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(2-chloranyl-4-fluoranyl-phenyl)-2-(4-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(2-chloro-4-fluoro-phenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-(2-chloro-4-fluorophenyl)-2-[4-[4-morpholinyl(oxo)methyl]-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(2-chloro-4-fluorophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(2-chloro-4-fluoro-phenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]propionamide Formula: C19H26ClFN3O3+ MolecularWeight: 398.879443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)[NH+]2CCC(CC2)C(=O)N3CCOCC3

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)F)Cl)[NH+]2CCC(CC2)C(=O)N3CCOCC3

InChI

InChI=1S/C19H25ClFN3O3/c1-13(18(25)22-17-3-2-15(21)12-16(17)20)23-6-4-14(5-7-23)19(26)24-8-10-27-11-9-24/h2-3,12-14H,4-11H2,1H3,(H,22,25)/p+1/t13-/m0/s1