HIT ID: HIT212672184
Cas No: 181885-68-7
分子式: C25H30ClN3O4
分子量: 471.98
常用名: LDS-751
氢键受体数 (HBA): 2
氢键供体数 (HBD): 0
LogP: 1.0388472
IUPAC: 6-(dimethylamino)-2-[(1E,3E)-4-[4-(dimethylamino)phenyl]buta-1,3-dien-1-yl]-1-ethylquinolin-1-ium perchlorate
IUPAC: 6-(dimethylamino)-2-[(1E,3E)-4-[4-(dimethylamino)phenyl]buta-1,3-dien-1-yl]-1-ethylquinolin-1-ium perchlorate
SMILES: [O-][Cl](=O)(=O)=O.CC[n+]1c(\C=C\C=C\c2ccc(cc2)N(C)C)ccc2cc(ccc12)N(C)C
SMILES: [O-][Cl](=O)(=O)=O.CC[n+]1c(\C=C\C=C\c2ccc(cc2)N(C)C)ccc2cc(ccc12)N(C)C
InChI key: FGBAVQUHSKYMTC-UHFFFAOYSA-M
