4-{[4-(aminomethyl)piperidin-1-yl]methyl}tetrahydro-2H-pyran-4-carboxylic acid 4-methylbenzenesulfonate

HCID 86602117

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基本情報

標準SMILES: Cc1ccc(S(=O)(=O)O)cc1.NCC1CCN(CC2(C(=O)O)CCOCC2)CC1
InChIKey: DDPOBNLIHHDQBD-UHFFFAOYSA-N
分子式: C20H32N2O6S
平均分子量: 428.5 g/mol
単同位体質量: 428.19810792

名称と識別子

優先名称: 4-{[4-(aminomethyl)piperidin-1-yl]methyl}tetrahydro-2H-pyran-4-carboxylic acid 4-methylbenzenesulfonate
IUPAC: 4-[[4-(aminomethyl)piperidin-1-yl]methyl]oxane-4-carboxylic acid;4-methylbenzenesulfonic acid

名称と別名

SCHEMBL1971158DDPOBNLIHHDQBD-UHFFFAOYSA-N4-{[4-(aminomethyl)piperidin-1-yl]methyl}tetrahydro-2H-pyran-4-carboxylic acid 4-methylbenze nesulfonate4-{[4-(aminomethyl)piperidin-1-yl]methyl}tetrahydro-2H-pyran-4-carboxylic acid 4-methylbenzenesulfonate