Chem
J-GLOBAL ID：200907039240031454   Nikkaji number：J1.884.348J

1-(4-Methylphenylsulfinylmethyl)-3,4-dihydroisoquinoline 2-oxide

1-(4-メチルフェニルスルフィニルメチル)-3,4-ジヒドロイソキノリン2-オキシド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C17H17[N+]O[O-]S
Molecular formula furigana： C17-H17-N-O2-S
Molecular weight： 299.390
InChI： InChI=1S/C17H17NO2S/c1-13-6-8-15(9-7-13)21(20)12-17-16-5-3-2-4-14(16)10-11-18(17)19/h2-9H,10-12H2,1H3
InChI key： SLASJHXLVAQKAK-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)S(=O)CC1=[N+]([O-])CCc2ccccc12
Systematic name  (3)：
  • 1-(4-メチルフェニルスルフィニルメチル)-3,4-ジヒドロイソキノリン2-オキシド
  • 1-[(4-メチルベンゼンスルフィニル)メチル]-3,4-ジヒドロイソキノリン-2-イウム-2-オラート
  • 1-[(4-methylbenzenesulfinyl)methyl]-3,4-dihydroisoquinolin-2-ium-2-olate
Other name (1)：
  • 1-(4-Methylphenylsulfinylmethyl)-3,4-dihydroisoquinoline 2-oxide
Thsaurus map：
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