HIT ID: HIT217659691
Cas No:
分子式: C28H23NaO2
分子量: 414.48
常用名: AGN 193109 sodium
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: sodium 4-{2-[5,5-dimethyl-8-(4-methylphenyl)-5,6-dihydronaphthalen-2-yl]ethynyl}benzoate
IUPAC: sodium 4-{2-[5,5-dimethyl-8-(4-methylphenyl)-5,6-dihydronaphthalen-2-yl]ethynyl}benzoate
SMILES: [Na+].Cc1ccc(cc1)C1=CCC(C)(C)c2ccc(cc12)C#Cc1ccc(cc1)C([O-])=O
SMILES: [Na+].Cc1ccc(cc1)C1=CCC(C)(C)c2ccc(cc12)C#Cc1ccc(cc1)C([O-])=O
InChI key: JPAQKCQBQPEIHW-UHFFFAOYSA-M
