Chem
J-GLOBAL ID：200907000959689725   Nikkaji number：J1.612.602K

1H-Indole-3-acetic acid [(S)-1-(3-bromo-4-methoxyphenyl)-2-phthalimidylethyl] ester

1H-インドール-3-酢酸[(S)-1-(3-ブロモ-4-メトキシフェニル)-2-フタルイミジルエチル]
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： C27H21BrN2O5
Molecular formula furigana： C27-H21-BR-N2-O5
Molecular weight： 533.378
InChI： InChI=1S/C27H21BrN2O5/c1-34-23-11-10-16(12-21(23)28)24(15-30-26(32)19-7-2-3-8-20(19)27(30)33)35-25(31)13-17-14-29-22-9-5-4-6-18(17)22/h2-12,14,24,29H,13,15H2,1H3/t24-/m1/s1
InChI key： BJEBDZGWTDVUTH-XMMPIXPASA-N
SMILES： COc1ccc(cc1Br)[C@@H](CN1C(=O)c2ccccc2C1=O)OC(=O)Cc1c[nH]c2ccccc12
Systematic name  (3)：
  • 1H-インドール-3-酢酸[(S)-1-(3-ブロモ-4-メトキシフェニル)-2-フタルイミジルエチル]
  • (1S)-1-(3-ブロモ-4-メトキシフェニル)-2-(1,3-ジオキソ-2,3-ジヒドロ-1H-イソインドール-2-イル)エチル 2-(1H-インドール-3-イル)アセタート
  • (1S)-1-(3-bromo-4-methoxyphenyl)-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl 2-(1H-indol-3-yl)acetate
Other name (1)：
  • 1H-Indole-3-acetic acid [(S)-1-(3-bromo-4-methoxyphenyl)-2-phthalimidylethyl] ester
Thsaurus map：
Thesaurus Map

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