Chem
J-GLOBAL ID:200907027270338912   Nikkaji number:J1.633.410C

(2S)-N-[(S)-4,α-Dimethylphenacyl]-2-(9H-fluorene-9-ylmethoxycarbonylamino)-3-methylvaleramide

(2S)-N-[(S)-4,α-ジメチルフェナシル]-2-(9H-フルオレン-9-イルメトキシカルボニルアミノ)-3-メチルバレルアミド
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: C31H34N2O4
Molecular formula furigana: C31-H34-N2-O4
Molecular weight: 498.623
InChI: InChI=1S/C31H34N2O4/c1-5-20(3)28(30(35)32-21(4)29(34)22-16-14-19(2)15-17-22)33-31(36)37-18-27-25-12-8-6-10-23(25)24-11-7-9-13-26(24)27/h6-17,20-21,27-28H,5,18H2,1-4H3,(H,32,35)(H,33,36)/t20?,21-,28-/m0/s1
InChI key: DDLZSNRXCUFSLD-ZRCWJPRMSA-N
SMILES: CCC(C)[C@H](NC(=O)OCC1c2ccccc2c2ccccc12)C(=O)N[C@@H](C)C(=O)c1ccc(C)cc1
Systematic name  (3):
  • (2S)-N-[(S)-4,α-ジメチルフェナシル]-2-(9H-フルオレン-9-イルメトキシカルボニルアミノ)-3-メチルバレルアミド
  • (9H-フルオレン-9-イル)メチル N-[(1S)-2-メチル-1-{[(2S)-1-(4-メチルフェニル)-1-オキソプロパン-2-イル]カルバモイル}ブチル]カルバマート
  • (9H-fluoren-9-yl)methyl N-[(1S)-2-methyl-1-{[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]carbamoyl}butyl]carbamate
Other name (1):
  • (2S)-N-[(S)-4,α-Dimethylphenacyl]-2-(9H-fluorene-9-ylmethoxycarbonylamino)-3-methylvaleramide
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