(3S)-1-[(3-morpholin-4-ylcarbonyl-2-oxidanyl-naphthalen-1-yl)methyl]-N-phenyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[(3-morpholin-4-ylcarbonyl-2-oxidanyl-naphthalen-1-yl)methyl]-N-phenyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[[2-hydroxy-3-(morpholine-4-carbonyl)-1-naphthyl]methyl]-N-phenyl-piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[[2-hydroxy-3-[4-morpholinyl(oxo)methyl]-1-naphthalenyl]methyl]-N-phenyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[[2-hydroxy-3-(morpholine-4-carbonyl)naphthalen-1-yl]methyl]-N-phenylpiperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[[2-hydroxy-3-(morpholine-4-carbonyl)-1-naphthyl]methyl]-N-phenyl-piperidin-1-ium-3-carboxamide Formula: C28H32N3O4+ MolecularWeight: 474.57138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H31N3O4/c32-26-24(28(34)31-13-15-35-16-14-31)17-20-7-4-5-11-23(20)25(26)19-30-12-6-8-21(18-30)27(33)29-22-9-2-1-3-10-22/h1-5,7,9-11,17,21,32H,6,8,12-16,18-19H2,(H,29,33)/p+1/t21-/m0/s1