Chem
J-GLOBAL ID：201207083840765995
Nikkaji number：J3.006.373B
5-Chloro-1-(tert-butoxycarbonyl)-3-(iodomethyl)-3-methyl-2,3-dihydro-1H-indole
5-クロロ-1-(tert-ブトキシカルボニル)-3-(ヨードメチル)-3-メチル-2,3-ジヒドロ-1H-インドール
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： C15H19ClINO2
Molecular formula furigana： C15-H19-CL-I-N-O2
Molecular weight： 407.680
InChI：
InChI=1S/C15H19ClINO2/c1-14(2,3)20-13(19)18-9-15(4,8-17)11-7-10(16)5-6-12(11)18/h5-7H,8-9H2,1-4H3
InChI key：
QFAYEKQZBYATAP-UHFFFAOYSA-N
SMILES：
CC(C)(C)OC(=O)N1CC(C)(CI)c2cc(Cl)ccc12
Systematic name (3)：
- 5-クロロ-1-(tert-ブトキシカルボニル)-3-(ヨードメチル)-3-メチル-2,3-ジヒドロ-1H-インドール
- tert-ブチル 5-クロロ-3-(ヨードメチル)-3-メチル-2,3-ジヒドロ-1H-インドール-1-カルボキシラート
- tert-butyl 5-chloro-3-(iodomethyl)-3-methyl-2,3-dihydro-1H-indole-1-carboxylate
- 5-Chloro-1-(tert-butoxycarbonyl)-3-(iodomethyl)-3-methyl-2,3-dihydro-1H-indole
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