Chem
J-GLOBAL ID:200907046912795861
Nikkaji number:J2.206.876H
3-[2-Oxo-2-(4-nitrophenyl)ethyl]-3-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine 1,1-dioxide
3-[2-オキソ-2-(4-ニトロフェニル)エチル]-3-メチル-3,4-ジヒドロ-2H-1,2,4-ベンゾチアジアジン1,1-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:
C16 H15 N2 [N+]O2 [O-]3 [S+2]
Molecular formula furigana:
C16-H15-N3-O5-S
Molecular weight:
361.370
InChI:
InChI=1S/C16H15N3O5S/c1-16(10-14(20)11-6-8-12(9-7-11)19(21)22)17-13-4-2-3-5-15(13)25(23,24)18-16/h2-9,17-18H,10H2,1H3
InChI key:
PPGBMOHNWGXMES-UHFFFAOYSA-N
SMILES:
CC1(CC(=O)c2ccc(cc2)[N+](=O)[O-])Nc2ccccc2[S+2]([O-])([O-])N1
Systematic name (3):
3-[2-オキソ-2-(4-ニトロフェニル)エチル]-3-メチル-3,4-ジヒドロ-2H-1,2,4-ベンゾチアジアジン1,1-ジオキシド
3-メチル-3-[2-(4-ニトロフェニル)-2-オキソエチル]-1,2,3,4-テトラヒドロ-1,2,4-ベンゾチアジアジン-1,1-ジイウム-1,1-ビス(オラート)
3-methyl-3-[2-(4-nitrophenyl)-2-oxoethyl]-1,2,3,4-tetrahydro-1,2,4-benzothiadiazine-1,1-diium-1,1-bis(olate)
Other name (1):
3-[2-Oxo-2-(4-nitrophenyl)ethyl]-3-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine 1,1-dioxide
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