Chem
J-GLOBAL ID:200907078666262742   Nikkaji number:J2.378.514E

1-[(1Z,2Z)-3-Phenyl-3-[(8aS)-7,8aβ,8bα-trimethyl-9,9,10,10,11,11-hexafluoro-4,5-propano-8a,8b-dihydrobenzo[2,1-b:3,4-b′]dithiophene-2-yl]-2-propenylidene]-1,2-dihydronaphthalene-2-one

1-[(1Z,2Z)-3-フェニル-3-[(8aS)-7,8aβ,8bα-トリメチル-9,9,10,10,11,11-ヘキサフルオロ-4,5-プロパノ-8a,8b-ジヒドロベンゾ[2,1-b:3,4-b′]ジチオフェン-2-イル]-2-プロペニリデン]-1,2-ジヒドロナフタレン-2-オン
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: C35H24F6OS2
Molecular formula furigana: C35-H24-F6-O-S2
Molecular weight: 638.690
InChI: InChI=1S/C35H24F6OS2/c1-19-17-25-29-30(34(38,39)35(40,41)33(29,36)37)26-18-28(44-32(26,3)31(25,2)43-19)23(20-9-5-4-6-10-20)14-15-24-22-12-8-7-11-21(22)13-16-27(24)42/h4-18H,1-3H3/b23-14-,24-15-/t31-,32-/m0/s1
InChI key: NLSUMSBWQRAUQB-WUCLQOQLSA-N
SMILES: CC1=CC2=C3C(=C4C=C(S[C@]4(C)[C@@]2(C)S1)/C(=C\C=C\1/C(=O)C=Cc2ccccc12)/c1ccccc1)C(F)(F)C(F)(F)C3(F)F
Systematic name  (3):
  • 1-[(1Z,2Z)-3-フェニル-3-[(8aS)-7,8aβ,8bα-トリメチル-9,9,10,10,11,11-ヘキサフルオロ-4,5-プロパノ-8a,8b-ジヒドロベンゾ[2,1-b:3,4-b′]ジチオフェン-2-イル]-2-プロペニリデン]-1,2-ジヒドロナフタレン-2-オン
  • (1Z)-1-[(2Z)-3-[(1S,2S)-8,8,9,9,10,10-ヘキサフルオロ-1,2,14-トリメチル-3,15-ジチアテトラシクロ[10.3.0.02,6.07,11]ペンタデカ-4,6,11,13-テトラエン-4-イル]-3-フェニルプロパ-2-エン-1-イリデン]-1,2-ジヒドロナフタレン-2-オン
  • (1Z)-1-[(2Z)-3-[(1S,2S)-8,8,9,9,10,10-hexafluoro-1,2,14-trimethyl-3,15-dithiatetracyclo[10.3.0.02,6.07,11]pentadeca-4,6,11,13-tetraen-4-yl]-3-phenylprop-2-en-1-ylidene]-1,2-dihydronaphthalen-2-one
Other name (1):
  • 1-[(1Z,2Z)-3-Phenyl-3-[(8aS)-7,8aβ,8bα-trimethyl-9,9,10,10,11,11-hexafluoro-4,5-propano-8a,8b-dihydrobenzo[2,1-b:3,4-b′]dithiophene-2-yl]-2-propenylidene]-1,2-dihydronaphthalene-2-one
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