2-[[(2-oxidanylidene-1H-quinazolin-4-yl)amino]methylidene]propanedioate

Systemtic Name: 2-[[(2-oxidanylidene-1H-quinazolin-4-yl)amino]methylidene]propanedioate Openeye Name: 2-[[(2-oxo-1H-quinazolin-4-yl)amino]methylene]propanedioate CAS Name: 2-[[(2-oxo-1H-quinazolin-4-yl)amino]methylidene]propanedioate IUPAC Name: 2-[[(2-oxo-1H-quinazolin-4-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(2-keto-1H-quinazolin-4-yl)amino]methylene]malonate Formula: C12H7N3O5-2 MolecularWeight: 273.20108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=O)N2)NC=C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=O)N2)NC=C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H9N3O5/c16-10(17)7(11(18)19)5-13-9-6-3-1-2-4-8(6)14-12(20)15-9/h1-5H,(H,16,17)(H,18,19)(H2,13,14,15,20)/p-2