Chem
J-GLOBAL ID:200907075588944603   Nikkaji number:J701.231D

[(R)-2-(1H-Indol-3-yl)-1-[[(S)-α-methylbenzyl]carbamoyl]ethyl]carbamic acid 4-methylbenzyl ester

[(R)-2-(1H-インドール-3-イル)-1-[[(S)-α-メチルベンジル]カルバモイル]エチル]カルバミド酸4-メチルベンジル
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: C28H29N3O3
Molecular formula furigana: C28-H29-N3-O3
Molecular weight: 455.558
InChI: InChI=1S/C28H29N3O3/c1-19-12-14-21(15-13-19)18-34-28(33)31-26(16-23-17-29-25-11-7-6-10-24(23)25)27(32)30-20(2)22-8-4-3-5-9-22/h3-15,17,20,26,29H,16,18H2,1-2H3,(H,30,32)(H,31,33)/t20-,26+/m0/s1
InChI key: BZISETQYKFZLOB-RXFWQSSRSA-N
SMILES: C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(C)cc1)c1ccccc1
Systematic name  (3):
  • [(R)-2-(1H-インドール-3-イル)-1-[[(S)-α-メチルベンジル]カルバモイル]エチル]カルバミド酸4-メチルベンジル
  • (4-メチルフェニル)メチル N-[(1R)-2-(1H-インドール-3-イル)-1-{[(1S)-1-フェニルエチル]カルバモイル}エチル]カルバマート
  • (4-methylphenyl)methyl N-[(1R)-2-(1H-indol-3-yl)-1-{[(1S)-1-phenylethyl]carbamoyl}ethyl]carbamate
Other name (1):
  • [(R)-2-(1H-Indol-3-yl)-1-[[(S)-α-methylbenzyl]carbamoyl]ethyl]carbamic acid 4-methylbenzyl ester
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