PTIO
HIT212725492
sdf文件结构编辑类似物检索
HIT ID: HIT212725492
Cas No: 18390-00-6
分子式: C13H17N2O2
分子量: 233.291
常用名: PTIO
氢键受体数 (HBA): 3
氢键供体数 (HBD): 0
LogP: -0.8301587
IUPAC: (4,4,5,5-tetramethyl-3-oxido-2-phenyl-4,5-dihydro-1H-imidazol-3-ium-1-yl)oxidanyl
IUPAC: (4,4,5,5-tetramethyl-3-oxido-2-phenyl-4,5-dihydro-1H-imidazol-3-ium-1-yl)oxidanyl
SMILES: CC1(C)N([O])C(c2ccccc2)=[N+]([O-])C1(C)C |t:12,^1:4|
SMILES: CC1(C)N([O])C(c2ccccc2)=[N+]([O-])C1(C)C |t:12,^1:4|
InChI key: DYUUGILMVYJEHY-UHFFFAOYSA-N
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