Chem
J-GLOBAL ID:200907021905203530   Nikkaji number:J1.190.830F

2,2′-Methylenebis[4β,5β-(9,10-dimethyl-9,10-dihydroanthracene-9β,10β-diyl)-4,5-dihydrooxazole]

2,2′-メチレンビス[4β,5β-(9,10-ジメチル-9,10-ジヒドロアントラセン-9β,10β-ジイル)-4,5-ジヒドロオキサゾール]
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: C39H34N2O2
Molecular formula furigana: C39-H34-N2-O2
Molecular weight: 562.713
InChI: InChI=1S/C39H34N2O2/c1-36-22-13-5-9-17-26(22)38(3,27-18-10-6-14-23(27)36)34-32(36)40-30(42-34)21-31-41-33-35(43-31)39(4)28-19-11-7-15-24(28)37(33,2)25-16-8-12-20-29(25)39/h5-20,32-35H,21H2,1-4H3/t32-,33-,34+,35+,36-,37?,38-,39-/m1/s1
InChI key: WKJGUBTWAJRRLD-OCISUHEHSA-N
SMILES: C[C@]12[C@H]3OC(=N[C@H]3[C@@](C)(c3ccccc13)c1ccccc21)CC1=N[C@@H]2[C@H](O1)[C@@]1(C)c3ccccc3C2(C)c2ccccc12
Systematic name  (3):
  • 2,2′-メチレンビス[4β,5β-(9,10-ジメチル-9,10-ジヒドロアントラセン-9β,10β-ジイル)-4,5-ジヒドロオキサゾール]
  • (15R,19S)-17-{[(15R,19S)-1,8-ジメチル-16-オキサ-18-アザペンタシクロ[6.6.5.02,7.09,14.015,19]ノナデカ-2,4,6,9,11,13,17-ヘプタエン-17-イル]メチル}-1,8-ジメチル-16-オキサ-18-アザペンタシクロ[6.6.5.02,7.09,14.015,19]ノナデカ-2,4,6,9,11,13,17-ヘプタエン
  • (15R,19S)-17-{[(15R,19S)-1,8-dimethyl-16-oxa-18-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13,17-heptaen-17-yl]methyl}-1,8-dimethyl-16-oxa-18-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13,17-heptaene
Other name (1):
  • 2,2′-Methylenebis[4β,5β-(9,10-dimethyl-9,10-dihydroanthracene-9β,10β-diyl)-4,5-dihydrooxazole]
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