Chem
J-GLOBAL ID:200907000086730812   Nikkaji number:J870.848G

(1S,2R)-2-(Diisopropylamino)indan-1-ol 4-nitrobenzoate

(1S,2R)-2-(ジイソプロピルアミノ)インダン-1-オール4-ニトロベンゾアート
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: C22H26N[N+]O3[O-]
Molecular formula furigana: C22-H26-N2-O4
Molecular weight: 382.460
InChI: InChI=1S/C22H26N2O4/c1-14(2)23(15(3)4)20-13-17-7-5-6-8-19(17)21(20)28-22(25)16-9-11-18(12-10-16)24(26)27/h5-12,14-15,20-21H,13H2,1-4H3/t20-,21+/m1/s1
InChI key: LBNSCBFPCSEFOC-RTWAWAEBSA-N
SMILES: CC(C)N(C(C)C)[C@@H]1Cc2ccccc2[C@@H]1OC(=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3):
  • (1S,2R)-2-(ジイソプロピルアミノ)インダン-1-オール4-ニトロベンゾアート
  • (1S,2R)-2-[ビス(プロパン-2-イル)アミノ]-2,3-ジヒドロ-1H-インデン-1-イル 4-ニトロベンゾアート
  • (1S,2R)-2-[bis(propan-2-yl)amino]-2,3-dihydro-1H-inden-1-yl 4-nitrobenzoate
Other name (1):
  • (1S,2R)-2-(Diisopropylamino)indan-1-ol 4-nitrobenzoate
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