4-[(3-oxidanidyl-3-oxidanylidene-propyl)amino]quinazoline-5-carboxylate

Systemtic Name: 4-[(3-oxidanidyl-3-oxidanylidene-propyl)amino]quinazoline-5-carboxylate Openeye Name: 4-[(3-oxido-3-oxo-propyl)amino]quinazoline-5-carboxylate CAS Name: 4-[(3-oxido-3-oxopropyl)amino]-5-quinazolinecarboxylate IUPAC Name: 4-[(3-oxido-3-oxopropyl)amino]quinazoline-5-carboxylate Traditional Name: 4-[(3-keto-3-oxido-propyl)amino]quinazoline-5-carboxylate Formula: C12H9N3O4-2 MolecularWeight: 259.21756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N=CN=C2NCCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)N=CN=C2NCCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H11N3O4/c16-9(17)4-5-13-11-10-7(12(18)19)2-1-3-8(10)14-6-15-11/h1-3,6H,4-5H2,(H,16,17)(H,18,19)(H,13,14,15)/p-2