Chem
J-GLOBAL ID：201907012870145476
Nikkaji number：J3.740.184F
tert-butyl (3S)-3-methyl-2-oxo-1H-indole-3-carboxylate
tert-ブチル(3S)-3-メチル-2-オキソ-1H-インドール-3-カルボキシラート
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
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
Molecular formula： C14H17NO3
Molecular formula furigana： C14-H17-N-O3
Molecular weight： 247.294
InChI：
InChI=1S/C14H17NO3/c1-13(2,3)18-12(17)14(4)9-7-5-6-8-10(9)15-11(14)16/h5-8H,1-4H3,(H,15,16)/t14-/m0/s1
InChI key：
XCOPYJOGSADATC-AWEZNQCLSA-N
SMILES：
C1(=O)[C@](c2ccccc2N1)(C(=O)OC(C)(C)C)C
Systematic name (3)：
- (S)-2-オキソ-3-メチル-2,3-ジヒドロ-1H-インドール-3-カルボン酸tert-ブチル
- tert-ブチル(3S)-3-メチル-2-オキソ-2,3-ジヒドロ-1H-インドール-3-カルボキシラート
- tert-butyl (3S)-3-methyl-2-oxo-2,3-dihydro-1H-indole-3-carboxylate
- tert-ブチル(3S)-3-メチル-2-オキソ-1H-インドール-3-カルボキシラート
- tert-butyl (3S)-3-methyl-2-oxo-1H-indole-3-carboxylate
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