7-butoxy-1-methyl-1-methylsulfanyl-quinolin-1-ium-4-one

Systemtic Name: 7-butoxy-1-methyl-1-methylsulfanyl-quinolin-1-ium-4-one Openeye Name: 7-butoxy-1-methyl-1-methylsulfanyl-quinolin-1-ium-4-one CAS Name: 7-butoxy-1-methyl-1-(methylthio)-4-quinolin-1-iumone IUPAC Name: 7-butoxy-1-methyl-1-methylsulfanylquinolin-1-ium-4-one Traditional Name: 7-butoxy-1-methyl-1-(methylthio)quinolin-1-ium-4-one Formula: C15H20NO2S+ MolecularWeight: 278.3898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=O)C=C[N+]2(C)SC

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=O)C=C[N+]2(C)SC

InChI

InChI=1S/C15H20NO2S/c1-4-5-10-18-12-6-7-13-14(11-12)16(2,19-3)9-8-15(13)17/h6-9,11H,4-5,10H2,1-3H3/q+1