Name: BaMbuterol-d9 Hydrochloride
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT214982531
Cas No:1794810-59-5
常用名:BaMbuterol-d9 Hydrochloride
IUPAC:3-[(dimethylcarbamoyl)oxy]-5-(1-hydroxy-2-{[2-(2H3)methyl(1,1,1,3,3,3-2H6)propan-2-yl]amino}ethyl)phenyl N,N-dimethylcarbamate hydrochloride
IUPAC:3-[(dimethylcarbamoyl)oxy]-5-(1-hydroxy-2-{[2-(2H3)methyl(1,1,1,3,3,3-2H6)propan-2-yl]amino}ethyl)phenyl N,N-dimethylcarbamate hydrochloride
InChI key:LBARATORRVNNQM-KYRNGWDOSA-N

分子式:C18H30ClN3O5
分子量:412.96
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Cl.[2H]C([2H])([2H])C(NCC(O)c1cc(OC(=O)N(C)C)cc(OC(=O)N(C)C)c1)(C([2H])([2H])[2H])C([2H])([2H])[2H]
SMILES:Cl.[2H]C([2H])([2H])C(NCC(O)c1cc(OC(=O)N(C)C)cc(OC(=O)N(C)C)c1)(C([2H])([2H])[2H])C([2H])([2H])[2H]

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