3-(7-methyl-5-oxidanidyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate

Systemtic Name: 3-(7-methyl-5-oxidanidyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate Openeye Name: 3-(7-methyl-5-oxido-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate CAS Name: 3-(7-methyl-5-oxido-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate IUPAC Name: 3-(7-methyl-5-oxido-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate Traditional Name: 3-(7-methyl-5-oxido-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propionate Formula: C9H8N4O3-2 MolecularWeight: 220.18482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=NC=NN12)[O-])CCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=NC2=NC=NN12)[O-])CCC(=O)[O-]

InChI

InChI=1S/C9H10N4O3/c1-5-6(2-3-7(14)15)8(16)12-9-10-4-11-13(5)9/h4H,2-3H2,1H3,(H,14,15)(H,10,11,12,16)/p-2