5-[3-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-1-prop-2-ynyl-3,4-dihydroquinolin-2-one chloride

Systemtic Name: 5-[3-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-1-prop-2-ynyl-3,4-dihydroquinolin-2-one chloride Openeye Name: 5-[3-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-1-prop-2-ynyl-3,4-dihydroquinolin-2-one chloride CAS Name: 5-[3-(1-methyl-4-phenyl-1-piperidin-1-iumyl)propoxy]-1-prop-2-ynyl-3,4-dihydroquinolin-2-one chloride IUPAC Name: 5-[3-(1-methyl-4-phenylpiperidin-1-ium-1-yl)propoxy]-1-prop-2-ynyl-3,4-dihydroquinolin-2-one chloride Traditional Name: 5-[3-(1-methyl-4-phenyl-piperidin-1-ium-1-yl)propoxy]-1-propargyl-3,4-dihydrocarbostyril chloride Formula: C27H33ClN2O2 MolecularWeight: 453.01612

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)C2=CC=CC=C2)CCCOC3=CC=CC4=C3CCC(=O)N4CC#C.[Cl-]

Isomeric SMILES

C[N+]1(CCC(CC1)C2=CC=CC=C2)CCCOC3=CC=CC4=C3CCC(=O)N4CC#C.[Cl-]

InChI

InChI=1S/C27H33N2O2.ClH/c1-3-17-28-25-11-7-12-26(24(25)13-14-27(28)30)31-21-8-18-29(2)19-15-23(16-20-29)22-9-5-4-6-10-22;/h1,4-7,9-12,23H,8,13-21H2,2H3;1H/q+1;/p-1