3-[[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]sulfonyl]propanoate

Systemtic Name: 3-[[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]sulfonyl]propanoate Openeye Name: 3-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]propanoate CAS Name: 3-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]propanoate IUPAC Name: 3-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]propanoate Traditional Name: 3-[(2,4-diketo-6-methyl-1H-pyrimidin-5-yl)sulfonyl]propionate Formula: C8H9N2O6S- MolecularWeight: 261.23186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)S(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)S(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C8H10N2O6S/c1-4-6(7(13)10-8(14)9-4)17(15,16)3-2-5(11)12/h2-3H2,1H3,(H,11,12)(H2,9,10,13,14)/p-1