HIT ID: HIT104022091
Cas No: 3209-10-7
分子式: C17H14Cl2O8
分子量: 417.19
常用名: Geodin hydrate
氢键受体数 (HBA): 6
氢键供体数 (HBD): 3
LogP: 4.741
IUPAC: 3,5-dichloro-2-hydroxy-6-[4-hydroxy-2-methoxy-6-(methoxycarbonyl)phenoxy]-4-methylbenzoic acid
IUPAC: 3,5-dichloro-2-hydroxy-6-[4-hydroxy-2-methoxy-6-(methoxycarbonyl)phenoxy]-4-methylbenzoic acid
SMILES: COC(=O)c1cc(O)cc(OC)c1Oc1c(Cl)c(C)c(Cl)c(O)c1C(O)=O
SMILES: COC(=O)c1cc(O)cc(OC)c1Oc1c(Cl)c(C)c(Cl)c(O)c1C(O)=O
InChI key: MYFFDMMUGIQJQM-UHFFFAOYSA-N
