Ac-Atovaquone
HIT219136903
sdf文件结构编辑类似物检索
HIT ID: HIT219136903
Cas No: 129700-44-3
分子式: C24H21ClO4
分子量: 408.88
常用名: Ac-Atovaquone
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 1,4-dioxo-3-[(1r,4r)-4-(4-chlorophenyl)cyclohexyl]-1,4-dihydronaphthalen-2-yl acetate
IUPAC: 1,4-dioxo-3-[(1r,4r)-4-(4-chlorophenyl)cyclohexyl]-1,4-dihydronaphthalen-2-yl acetate
SMILES: CC(=O)OC1=C([C@H]2CC[C@@H](CC2)c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O
SMILES: CC(=O)OC1=C([C@H]2CC[C@@H](CC2)c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O
InChI key: SQMKZWUACDCBHB-JCNLHEQBSA-N
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