1-(4-methoxy-3-methyl-phenyl)-2-(4-methylquinolin-1-ium-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-methoxy-3-methyl-phenyl)-2-(4-methylquinolin-1-ium-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-methoxy-3-methyl-phenyl)-2-(4-methylquinolin-1-ium-2-yl)sulfanyl-ethanone CAS Name: 1-(4-methoxy-3-methylphenyl)-2-[(4-methyl-2-quinolin-1-iumyl)thio]ethanone IUPAC Name: 1-(4-methoxy-3-methylphenyl)-2-(4-methylquinolin-1-ium-2-yl)sulfanylethanone Traditional Name: 1-(4-methoxy-3-methyl-phenyl)-2-[(4-methylquinolin-1-ium-2-yl)thio]ethanone Formula: C20H20NO2S+ MolecularWeight: 338.4433

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=CC=CC=C12)SCC(=O)C3=CC(=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=[NH+]C2=CC=CC=C12)SCC(=O)C3=CC(=C(C=C3)OC)C

InChI

InChI=1S/C20H19NO2S/c1-13-11-20(21-17-7-5-4-6-16(13)17)24-12-18(22)15-8-9-19(23-3)14(2)10-15/h4-11H,12H2,1-3H3/p+1