Chem
J-GLOBAL ID：201507008889475888   Nikkaji number：J3.449.574B

(7R,3′aS)-3-(1-Naphthyl)-3′,3′-diisopropyl-3′,3′aα,4,4′,5,5′-hexahydrospiro[2,1-benzoisoxazole-7(6H),6′-[6H]cyclopenta[c]isoxazole]

(7R,3a′S)-3-(1-ナフチル)-3′,3′-ジイソプロピル-4,5,3a′,4′-テトラヒドロスピロ[[2,1]ベンゾイソオキサゾール-7(6H),6′(5′H)-[3H]シクロペンタ[c]イソオキサゾール]
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： C28H32N2O2
Molecular formula furigana： C28-H32-N2-O2
Molecular weight： 428.576
InChI： InChI=1S/C28H32N2O2/c1-17(2)28(18(3)4)23-14-16-27(26(23)30-32-28)15-8-13-22-24(31-29-25(22)27)21-12-7-10-19-9-5-6-11-20(19)21/h5-7,9-12,17-18,23H,8,13-16H2,1-4H3/t23-,27-/m0/s1
InChI key： AYALEXJQSIQUDX-HOFKKMOUSA-N
SMILES： CC(C)C1(ON=C2[C@@H]1CC[C@@]12CCCc2c1noc2c1cccc2ccccc12)C(C)C
Systematic name  (4)：
  • (7R,3a′S)-3-(1-ナフチル)-3′,3′-ジイソプロピル-4,5,3a′,4′-テトラヒドロスピロ[[2,1]ベンゾイソオキサゾール-7(6H),6′(5′H)-[3H]シクロペンタ[c]イソオキサゾール]
  • (7R,3′aS)-3-(1-ナフチル)-3′,3′-ジイソプロピル-3′,3′aα,4,4′,5,5′-ヘキサヒドロスピロ[2,1-ベンゾイソオキサゾール-7(6H),6′-[6H]シクロペンタ[c]イソオキサゾール]
  • (3'aS,7R)-3-(ナフタレン-1-イル)-3',3'-ビス(プロパン-2-イル)-3',3'a,4',5,5',6-ヘキサヒドロ-4H-スピロ[2,1-ベンゾオキサゾール-7,6'-シクロペンタ[c][1,2]オキサゾール]
  • (3'aS,7R)-3-(naphthalen-1-yl)-3',3'-bis(propan-2-yl)-3',3'a,4',5,5',6-hexahydro-4H-spiro[2,1-benzoxazole-7,6'-cyclopenta[c][1,2]oxazole]
Other name (2)：
  • (7R,3a′S)-3-(1-Naphthyl)-3′,3′-diisopropyl-4,5,3a′,4′-tetrahydrospiro[[2,1]benzoisoxazole-7(6H),6′(5′H)-[3H]cyclopenta[c]isoxazole]
  • (7R,3′aS)-3-(1-Naphthyl)-3′,3′-diisopropyl-3′,3′aα,4,4′,5,5′-hexahydrospiro[2,1-benzoisoxazole-7(6H),6′-[6H]cyclopenta[c]isoxazole]
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