Chem
J-GLOBAL ID:200907052451362224
Nikkaji number:J1.098.595A
3-[(2-Acetoxyethoxy)methyl]-1H-2,1,3-benzothiadiazine-4(3H)-one 2,2-dioxide
3-[(2-アセトキシエトキシ)メチル]-1H-2,1,3-ベンゾチアジアジン-4(3H)-オン2,2-ジオキシド
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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:
C12 H14 N2 O4 [O-]2 [S+2]
Molecular formula furigana:
C12-H14-N2-O6-S
Molecular weight:
314.310
InChI:
InChI=1S/C12H14N2O6S/c1-9(15)20-7-6-19-8-14-12(16)10-4-2-3-5-11(10)13-21(14,17)18/h2-5,13H,6-8H2,1H3
InChI key:
BJWSEASFGRQKNH-UHFFFAOYSA-N
SMILES:
CC(=O)OCCOCN1C(=O)c2ccccc2N[S+2]1([O-])[O-]
Systematic name (3):
3-[(2-アセトキシエトキシ)メチル]-1H-2,1,3-ベンゾチアジアジン-4(3H)-オン2,2-ジオキシド
3-{[2-(アセチルオキシ)エトキシ]メチル}-4-オキソ-1,2,3,4-テトラヒドロ-2,1,3-ベンゾチアジアジン-2,2-ジイウム-2,2-ビス(オラート)
3-{[2-(acetyloxy)ethoxy]methyl}-4-oxo-1,2,3,4-tetrahydro-2,1,3-benzothiadiazine-2,2-diium-2,2-bis(olate)
Other name (1):
3-[(2-Acetoxyethoxy)methyl]-1H-2,1,3-benzothiadiazine-4(3H)-one 2,2-dioxide
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