Chem
J-GLOBAL ID:201007065736304738
Nikkaji number:J2.801.778B
N-[(2S,3S)-2-Methyl-3-[(4-nitrophenyl)amino]-3-phenylpropyl]carbamic acid benzyl ester
N-[(2S,3S)-2-メチル-3-[(4-ニトロフェニル)アミノ]-3-フェニルプロピル]カルバミド酸ベンジル
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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:
C24 H25 N2 [N+]O3 [O-]
Molecular formula furigana:
C24-H25-N3-O4
Molecular weight:
419.481
InChI:
InChI=1S/C24H25N3O4/c1-18(16-25-24(28)31-17-19-8-4-2-5-9-19)23(20-10-6-3-7-11-20)26-21-12-14-22(15-13-21)27(29)30/h2-15,18,23,26H,16-17H2,1H3,(H,25,28)/t18-,23-/m0/s1
InChI key:
LLIHQKHZSCFOHG-MBSDFSHPSA-N
SMILES:
C[C@@H](CNC(=O)OCc1ccccc1)[C@H](Nc1ccc(cc1)[N+](=O)[O-])c1ccccc1
Systematic name (3):
N-[(2S,3S)-2-メチル-3-[(4-ニトロフェニル)アミノ]-3-フェニルプロピル]カルバミド酸ベンジル
ベンジル N-[(2S,3S)-2-メチル-3-[(4-ニトロフェニル)アミノ]-3-フェニルプロピル]カルバマート
benzyl N-[(2S,3S)-2-methyl-3-[(4-nitrophenyl)amino]-3-phenylpropyl]carbamate
Other name (1):
N-[(2S,3S)-2-Methyl-3-[(4-nitrophenyl)amino]-3-phenylpropyl]carbamic acid benzyl ester
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