2-(1,2-oxazol-5-ylmethyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-(1,2-oxazol-5-ylmethyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-(isoxazol-5-ylmethyl)-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-(5-isoxazolylmethyl)-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-(1,2-oxazol-5-ylmethyl)-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-(isoxazol-5-ylmethyl)-4-keto-1H-quinazoline-7-carboxylate Formula: C13H8N3O4- MolecularWeight: 270.22032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])NC(=NC2=O)CC3=CC=NO3

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])NC(=NC2=O)CC3=CC=NO3

InChI

InChI=1S/C13H9N3O4/c17-12-9-2-1-7(13(18)19)5-10(9)15-11(16-12)6-8-3-4-14-20-8/h1-5H,6H2,(H,18,19)(H,15,16,17)/p-1