Chem
J-GLOBAL ID：201007038145550295   Nikkaji number：J2.801.773A

N-[(S)-3-[(4-Nitrophenyl)amino]-3-(2-furanyl)propyl]carbamic acid benzyl ester

N-[(S)-3-[(4-ニトロフェニル)アミノ]-3-(2-フラニル)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： C21H21N2[N+]O4[O-]
Molecular formula furigana： C21-H21-N3-O5
Molecular weight： 395.415
InChI： InChI=1S/C21H21N3O5/c25-21(29-15-16-5-2-1-3-6-16)22-13-12-19(20-7-4-14-28-20)23-17-8-10-18(11-9-17)24(26)27/h1-11,14,19,23H,12-13,15H2,(H,22,25)/t19-/m0/s1
InChI key： BBCCLKCYRNRIDH-IBGZPJMESA-N
SMILES： [O-][N+](=O)c1ccc(N[C@@H](CCNC(=O)OCc2ccccc2)c2ccco2)cc1
Systematic name  (3)：
  • N-[(S)-3-[(4-ニトロフェニル)アミノ]-3-(2-フラニル)プロピル]カルバミド酸ベンジル
  • ベンジル N-[(3S)-3-(フラン-2-イル)-3-[(4-ニトロフェニル)アミノ]プロピル]カルバマート
  • benzyl N-[(3S)-3-(furan-2-yl)-3-[(4-nitrophenyl)amino]propyl]carbamate
Other name (1)：
  • N-[(S)-3-[(4-Nitrophenyl)amino]-3-(2-furanyl)propyl]carbamic acid benzyl ester
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