Chem
J-GLOBAL ID：201007017828476050   Nikkaji number：J2.801.781B

N-[(2S,3S)-2-Methyl-3-[(4-nitrophenyl)amino]-3-(1,1′-biphenyl-4-yl)propyl]carbamic acid benzyl ester

N-[(2S,3S)-2-メチル-3-[(4-ニトロフェニル)アミノ]-3-(1,1′-ビフェニル-4-イル)プロピル]カルバミド酸ベンジル
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： C30H29N2[N+]O3[O-]
Molecular formula furigana： C30-H29-N3-O4
Molecular weight： 495.579
InChI： InChI=1S/C30H29N3O4/c1-22(20-31-30(34)37-21-23-8-4-2-5-9-23)29(32-27-16-18-28(19-17-27)33(35)36)26-14-12-25(13-15-26)24-10-6-3-7-11-24/h2-19,22,29,32H,20-21H2,1H3,(H,31,34)/t22-,29-/m0/s1
InChI key： COZQWRJBQTXUKT-ZTOMLWHTSA-N
SMILES： C[C@@H](CNC(=O)OCc1ccccc1)[C@H](Nc1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)c1ccccc1
Systematic name  (3)：
  • N-[(2S,3S)-2-メチル-3-[(4-ニトロフェニル)アミノ]-3-(1,1′-ビフェニル-4-イル)プロピル]カルバミド酸ベンジル
  • ベンジル N-[(2S,3S)-3-{[1,1'-ビフェニル]-4-イル}-2-メチル-3-[(4-ニトロフェニル)アミノ]プロピル]カルバマート
  • benzyl N-[(2S,3S)-3-{[1,1'-biphenyl]-4-yl}-2-methyl-3-[(4-nitrophenyl)amino]propyl]carbamate
Other name (1)：
  • N-[(2S,3S)-2-Methyl-3-[(4-nitrophenyl)amino]-3-(1,1′-biphenyl-4-yl)propyl]carbamic acid benzyl ester
Thsaurus map：
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