Chem
J-GLOBAL ID：200907081284045009   Nikkaji number：J2.233.748C

(1R,2S)-1,2-Bis(3,8-dimethyl-5-isopropylazulene-1-yl)-1,2-bis(2-pyrrolyl)ethane

(1R,2S)-1,2-ビス(3,8-ジメチル-5-イソプロピルアズレン-1-イル)-1,2-ビス(2-ピロリル)エタン
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： C40H44N2
Molecular formula furigana： C40-H44-N2
Molecular weight： 552.806
InChI： InChI=1S/C40H44N2/c1-23(2)29-15-13-25(5)37-31(21-29)27(7)19-33(37)39(35-11-9-17-41-35)40(36-12-10-18-42-36)34-20-28(8)32-22-30(24(3)4)16-14-26(6)38(32)34/h9-24,39-42H,1-8H3/t39-,40+
InChI key： LBONPVULUWRGER-LQDDJWCHSA-N
SMILES： CC(C)c1ccc(C)c2c(cc(C)c2c1)[C@@H]([C@H](c1ccc[nH]1)c1cc(C)c2cc(ccc(C)c12)C(C)C)c1ccc[nH]1
Systematic name  (3)：
  • (1R,2S)-1,2-ビス(3,8-ジメチル-5-イソプロピルアズレン-1-イル)-1,2-ビス(2-ピロリル)エタン
  • 2-[(1S,2R)-1,2-ビス[3,8-ジメチル-5-(プロパン-2-イル)アズレン-1-イル]-2-(1H-ピロール-2-イル)エチル]-1H-ピロール
  • 2-[(1S,2R)-1,2-bis[3,8-dimethyl-5-(propan-2-yl)azulen-1-yl]-2-(1H-pyrrol-2-yl)ethyl]-1H-pyrrole
Other name (1)：
  • (1R,2S)-1,2-Bis(3,8-dimethyl-5-isopropylazulene-1-yl)-1,2-bis(2-pyrrolyl)ethane
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