CellTracker CM-DiI
HIT218847712
sdf文件结构编辑类似物检索
HIT ID: HIT218847712
Cas No: 180854-97-1
分子式: C68H105Cl2N3O
分子量: 1051.51
常用名: CellTracker CM-DiI
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-({[4-(chloromethyl)phenyl]formamido}methyl)-2-[3-(3,3-dimethyl-1-octadecyl-2,3-dihydro-1H-indol-2-ylidene)prop-1-en-1-yl]-3,3-dimethyl-1-octadecyl-3H-indol-1-ium chloride
IUPAC: 5-({[4-(chloromethyl)phenyl]formamido}methyl)-2-[3-(3,3-dimethyl-1-octadecyl-2,3-dihydro-1H-indol-2-ylidene)prop-1-en-1-yl]-3,3-dimethyl-1-octadecyl-3H-indol-1-ium chloride
SMILES: [Cl-].CCCCCCCCCCCCCCCCCCN1C(=CC=CC2=[N+](CCCCCCCCCCCCCCCCCC)c3ccc(CNC(=O)c4ccc(CCl)cc4)cc3C2(C)C)C(C)(C)c2ccccc12
SMILES: [Cl-].CCCCCCCCCCCCCCCCCCN1C(=CC=CC2=[N+](CCCCCCCCCCCCCCCCCC)c3ccc(CNC(=O)c4ccc(CCl)cc4)cc3C2(C)C)C(C)(C)c2ccccc12
InChI key: KIBIHOGAIMOBNZ-UHFFFAOYSA-N
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