(3S)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-naphthalen-1-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-naphthalen-1-ylcarbonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-1-[1-naphthalenyl(oxo)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide Traditional Name: (3S)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]-1-(1-naphthoyl)nipecotamide Formula: C27H31N4O3+ MolecularWeight: 459.56004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC3=CC=CC=C32)C(=O)NCC4=C([NH+]=CC=C4)N5CCOCC5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC=CC3=CC=CC=C32)C(=O)NCC4=C([NH+]=CC=C4)N5CCOCC5

InChI

InChI=1S/C27H30N4O3/c32-26(29-18-21-8-4-12-28-25(21)30-14-16-34-17-15-30)22-9-5-13-31(19-22)27(33)24-11-3-7-20-6-1-2-10-23(20)24/h1-4,6-8,10-12,22H,5,9,13-19H2,(H,29,32)/p+1/t22-/m0/s1