Chem
J-GLOBAL ID:200907048383552446   Nikkaji number:J2.082.710F

(3R,7R,8S)-α-(1-Methyl-1H-indole-2-yl)-3-phenyl-8-ethyl-5-oxo-2,3,6,7,8,8a-hexahydro-5H-oxazolo[3,2-a]pyridine-7-acetic acid methyl ester

(3R,7R,8S)-α-(1-メチル-1H-インドール-2-イル)-3-フェニル-8-エチル-5-オキソ-2,3,6,7,8,8a-ヘキサヒドロ-5H-オキサゾロ[3,2-a]ピリジン-7-酢酸メチル
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: C27H30N2O4
Molecular formula furigana: C27-H30-N2-O4
Molecular weight: 446.547
InChI: InChI=1S/C27H30N2O4/c1-4-19-20(15-24(30)29-23(16-33-26(19)29)17-10-6-5-7-11-17)25(27(31)32-3)22-14-18-12-8-9-13-21(18)28(22)2/h5-14,19-20,23,25-26H,4,15-16H2,1-3H3/t19-,20+,23-,25?,26?/m0/s1
InChI key: IVAWWFMKFVFCDK-AJIDWMNWSA-N
SMILES: CC[C@@H]1C2OC[C@H](N2C(=O)C[C@H]1C(C(=O)OC)c1cc2ccccc2n1C)c1ccccc1
Systematic name  (3):
  • (3R,7R,8S)-α-(1-メチル-1H-インドール-2-イル)-3-フェニル-8-エチル-5-オキソ-2,3,6,7,8,8a-ヘキサヒドロ-5H-オキサゾロ[3,2-a]ピリジン-7-酢酸メチル
  • メチル 2-[(3R,7R,8S)-8-エチル-5-オキソ-3-フェニル-ヘキサヒドロ-2H-[1,3]オキサゾロ[3,2-a]ピリジン-7-イル]-2-(1-メチル-1H-インドール-2-イル)アセタート
  • methyl 2-[(3R,7R,8S)-8-ethyl-5-oxo-3-phenyl-hexahydro-2H-[1,3]oxazolo[3,2-a]pyridin-7-yl]-2-(1-methyl-1H-indol-2-yl)acetate
Other name (1):
  • (3R,7R,8S)-α-(1-Methyl-1H-indole-2-yl)-3-phenyl-8-ethyl-5-oxo-2,3,6,7,8,8a-hexahydro-5H-oxazolo[3,2-a]pyridine-7-acetic acid methyl ester
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