Chem
J-GLOBAL ID:201207013172512879   Nikkaji number:J3.069.794D

2-Ethyl-7-methoxy-4-oxo-4H-3,1-benzooxathiin 1-oxide

2-エチル-7-メトキシ-4-オキソ-4H-3,1-ベンゾオキサチイン1-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: C11H12O3[O-][S+]
Molecular formula furigana: C11-H12-O4-S
Molecular weight: 240.270
InChI: InChI=1S/C11H12O4S/c1-3-10-15-11(12)8-5-4-7(14-2)6-9(8)16(10)13/h4-6,10H,3H2,1-2H3
InChI key: HGPYPJXFYYGQQO-UHFFFAOYSA-N
SMILES: CCC1OC(=O)c2ccc(OC)cc2[S+]1[O-]
Systematic name  (3):
  • 2-エチル-7-メトキシ-4-オキソ-4H-3,1-ベンゾオキサチイン1-オキシド
  • 2-エチル-7-メトキシ-4-オキソ-2,4-ジヒドロ-1H-3,1-ベンゾオキサチイン-1-イウム-1-オラート
  • 2-ethyl-7-methoxy-4-oxo-2,4-dihydro-1H-3,1-benzoxathiin-1-ium-1-olate
Other name (1):
  • 2-Ethyl-7-methoxy-4-oxo-4H-3,1-benzooxathiin 1-oxide
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