methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfamoyl]-3-methyl-butanoate; piperidin-1-ium

Systemtic Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfamoyl]-3-methyl-butanoate; piperidin-1-ium Openeye Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfamoyl]-3-methyl-butanoate; piperidin-1-ium CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)sulfamoyl]-3-methylbutanoic acid methyl ester; piperidin-1-ium IUPAC Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)sulfamoyl]-3-methylbutanoate; piperidin-1-ium Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)sulfamoyl]-3-methyl-butyric acid methyl ester; piperidin-1-ium Formula: C17H31N4O6S+ MolecularWeight: 419.51624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)S(=O)(=O)NC1=NC(=CC(=N1)OC)OC.C1CC[NH2+]CC1

Isomeric SMILES

CC(C)C(C(=O)OC)S(=O)(=O)NC1=NC(=CC(=N1)OC)OC.C1CC[NH2+]CC1

InChI

InChI=1S/C12H19N3O6S.C5H11N/c1-7(2)10(11(16)21-5)22(17,18)15-12-13-8(19-3)6-9(14-12)20-4;1-2-4-6-5-3-1/h6-7,10H,1-5H3,(H,13,14,15);6H,1-5H2/p+1