HIT ID: HIT212063758
Cas No: 135459-87-9
分子式: C12H6N2O8SSr2
分子量: 513.49
常用名: Strontium ranelate
氢键受体数 (HBA): 10
氢键供体数 (HBD): 0
LogP: -13.703
IUPAC: distrontium(2+) 5-[bis(carboxylatomethyl)amino]-3-(carboxylatomethyl)-4-cyanothiophene-2-carboxylate
IUPAC: distrontium(2+) 5-[bis(carboxylatomethyl)amino]-3-(carboxylatomethyl)-4-cyanothiophene-2-carboxylate
SMILES: [Sr++].[Sr++].[O-]C(=O)CN(CC([O-])=O)c1sc(C([O-])=O)c(CC([O-])=O)c1C#N
SMILES: [Sr++].[Sr++].[O-]C(=O)CN(CC([O-])=O)c1sc(C([O-])=O)c(CC([O-])=O)c1C#N
InChI key: XXUZFRDUEGQHOV-UHFFFAOYSA-J
