5-[3-(1-methyl-4-oxidanyl-4-phenyl-piperidin-1-ium-1-yl)-2-oxidanyl-propoxy]-3,4-dihydro-1H-quinolin-2-one iodide

Systemtic Name: 5-[3-(1-methyl-4-oxidanyl-4-phenyl-piperidin-1-ium-1-yl)-2-oxidanyl-propoxy]-3,4-dihydro-1H-quinolin-2-one iodide Openeye Name: 5-[2-hydroxy-3-(4-hydroxy-1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-3,4-dihydro-1H-quinolin-2-one iodide CAS Name: 5-[2-hydroxy-3-(4-hydroxy-1-methyl-4-phenyl-1-piperidin-1-iumyl)propoxy]-3,4-dihydro-1H-quinolin-2-one iodide IUPAC Name: 5-[2-hydroxy-3-(4-hydroxy-1-methyl-4-phenylpiperidin-1-ium-1-yl)propoxy]-3,4-dihydro-1H-quinolin-2-one iodide Traditional Name: 5-[2-hydroxy-3-(4-hydroxy-1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-3,4-dihydrocarbostyril iodide Formula: C24H31IN2O4 MolecularWeight: 538.41841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)(C2=CC=CC=C2)O)CC(COC3=CC=CC4=C3CCC(=O)N4)O.[I-]

Isomeric SMILES

C[N+]1(CCC(CC1)(C2=CC=CC=C2)O)CC(COC3=CC=CC4=C3CCC(=O)N4)O.[I-]

InChI

InChI=1S/C24H30N2O4.HI/c1-26(14-12-24(29,13-15-26)18-6-3-2-4-7-18)16-19(27)17-30-22-9-5-8-21-20(22)10-11-23(28)25-21;/h2-9,19,27,29H,10-17H2,1H3;1H