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

Systemtic Name: 5-[3-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)-2-oxidanyl-propoxy]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one iodide Openeye Name: 1-benzyl-5-[2-hydroxy-3-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-3,4-dihydroquinolin-2-one iodide CAS Name: 5-[2-hydroxy-3-(1-methyl-4-phenyl-1-piperidin-1-iumyl)propoxy]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one iodide IUPAC Name: 1-benzyl-5-[2-hydroxy-3-(1-methyl-4-phenylpiperidin-1-ium-1-yl)propoxy]-3,4-dihydroquinolin-2-one iodide Traditional Name: 1-benzyl-5-[2-hydroxy-3-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-3,4-dihydrocarbostyril iodide Formula: C31H37IN2O3 MolecularWeight: 612.54155

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)C2=CC=CC=C2)CC(COC3=CC=CC4=C3CCC(=O)N4CC5=CC=CC=C5)O.[I-]

Isomeric SMILES

C[N+]1(CCC(CC1)C2=CC=CC=C2)CC(COC3=CC=CC4=C3CCC(=O)N4CC5=CC=CC=C5)O.[I-]

InChI

InChI=1S/C31H37N2O3.HI/c1-33(19-17-26(18-20-33)25-11-6-3-7-12-25)22-27(34)23-36-30-14-8-13-29-28(30)15-16-31(35)32(29)21-24-9-4-2-5-10-24;/h2-14,26-27,34H,15-23H2,1H3;1H/q+1;/p-1