Arteflene
HIT219251193
sdf文件结构编辑类似物检索
HIT ID: HIT219251193
Cas No: 123407-36-3
分子式: C19H18F6O3
分子量: 408.34
常用名: Arteflene
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1S,4R,5R,8S)-4-[(1E)-2-[2,4-bis(trifluoromethyl)phenyl]ethenyl]-4,8-dimethyl-2,3-dioxabicyclo[3.3.1]nonan-7-one
IUPAC: (1S,4R,5R,8S)-4-[(1E)-2-[2,4-bis(trifluoromethyl)phenyl]ethenyl]-4,8-dimethyl-2,3-dioxabicyclo[3.3.1]nonan-7-one
SMILES: [H][C@]12C[C@]([H])(CC(=O)[C@H]1C)[C@@](C)(OO2)\C=C\c1ccc(cc1C(F)(F)F)C(F)(F)F
SMILES: [H][C@]12C[C@]([H])(CC(=O)[C@H]1C)[C@@](C)(OO2)\C=C\c1ccc(cc1C(F)(F)F)C(F)(F)F
InChI key: LRTRTVPZZJAADL-IWTJFVNHSA-N
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