5-methyl-3-(3-oxidanidyl-3-oxidanylidene-propyl)-1,2-oxazole-4-carboxylate

Systemtic Name: 5-methyl-3-(3-oxidanidyl-3-oxidanylidene-propyl)-1,2-oxazole-4-carboxylate Openeye Name: 5-methyl-3-(3-oxido-3-oxo-propyl)isoxazole-4-carboxylate CAS Name: 5-methyl-3-(3-oxido-3-oxopropyl)-4-isoxazolecarboxylate IUPAC Name: 5-methyl-3-(3-oxido-3-oxopropyl)-1,2-oxazole-4-carboxylate Traditional Name: 3-(3-keto-3-oxido-propyl)-5-methyl-isoxazole-4-carboxylate Formula: C8H7NO5-2 MolecularWeight: 197.14488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C8H9NO5/c1-4-7(8(12)13)5(9-14-4)2-3-6(10)11/h2-3H2,1H3,(H,10,11)(H,12,13)/p-2