Chem
J-GLOBAL ID:200907042723363734   Nikkaji number:J1.680.318I

(1R)-1α-Phenyl-3α-(4-methoxyphenyl)-2,3,3a,11bβ-tetrahydro-1H-cyclopenta[l]phenanthrene-3aβ-carbonitrile

(1R)-1α-フェニル-3α-(4-メトキシフェニル)-2,3,3a,11bβ-テトラヒドロ-1H-シクロペンタ[l]フェナントレン-3aβ-カルボニトリル
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: C31H25NO
Molecular formula furigana: C31-H25-N-O
Molecular weight: 427.547
InChI: InChI=1S/C31H25NO/c1-33-23-17-15-22(16-18-23)29-19-27(21-9-3-2-4-10-21)30-26-13-6-5-11-24(26)25-12-7-8-14-28(25)31(29,30)20-32/h2-18,27,29-30H,19H2,1H3/t27-,29+,30+,31-/m0/s1
InChI key: QNRTZWDWIBEEJP-QGAYDTHSSA-N
SMILES: COc1ccc(cc1)[C@H]1C[C@H]([C@H]2c3ccccc3c3ccccc3[C@@]12C#N)c1ccccc1
Systematic name  (3):
  • (1R)-1α-フェニル-3α-(4-メトキシフェニル)-2,3,3a,11bβ-テトラヒドロ-1H-シクロペンタ[l]フェナントレン-3aβ-カルボニトリル
  • (1R,3R,3aR,11bS)-3-(4-メトキシフェニル)-1-フェニル-1H,2H,3H,3aH,11bH-シクロペンタ[l]フェナントレン-3a-カルボニトリル
  • (1R,3R,3aR,11bS)-3-(4-methoxyphenyl)-1-phenyl-1H,2H,3H,3aH,11bH-cyclopenta[l]phenanthrene-3a-carbonitrile
Other name (1):
  • (1R)-1α-Phenyl-3α-(4-methoxyphenyl)-2,3,3a,11bβ-tetrahydro-1H-cyclopenta[l]phenanthrene-3aβ-carbonitrile
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