Chem
J-GLOBAL ID:200907053109289376
Nikkaji number:J325.657J
2-[4-Methoxybenzyl]-1,2-benzisothiazol-3(2H)-one
2-(4-メトキシベンジル)-1,2-ベンゾイソチアゾール-3(2H)-オン
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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:
C15 H13 NO2 S
Molecular formula furigana:
C15-H13-N-O2-S
Molecular weight:
271.330
InChI:
InChI=1S/C15H13NO2S/c1-18-12-8-6-11(7-9-12)10-16-15(17)13-4-2-3-5-14(13)19-16/h2-9H,10H2,1H3
InChI key:
BBUMBHPLXMNIMZ-UHFFFAOYSA-N
SMILES:
COc1ccc(Cn2sc3ccccc3c2=O)cc1
Systematic name (4):
2-[4-メトキシベンジル]-1,2-ベンゾイソチアゾール-3(2H)-オン
2-(4-メトキシベンジル)-1,2-ベンゾイソチアゾール-3(2H)-オン
2-[(4-メトキシフェニル)メチル]-2,3-ジヒドロ-1,2-ベンゾチアゾール-3-オン
2-[(4-methoxyphenyl)methyl]-2,3-dihydro-1,2-benzothiazol-3-one
Other name (2):
2-[4-Methoxybenzyl]-1,2-benzisothiazol-3(2H)-one
2-(4-Methoxybenzyl)-1,2-benzisothiazole-3(2H)-one
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