2-[[(7-methoxyquinazolin-4-yl)amino]methylidene]propanedioate

Systemtic Name: 2-[[(7-methoxyquinazolin-4-yl)amino]methylidene]propanedioate Openeye Name: 2-[[(7-methoxyquinazolin-4-yl)amino]methylene]propanedioate CAS Name: 2-[[(7-methoxy-4-quinazolinyl)amino]methylidene]propanedioate IUPAC Name: 2-[[(7-methoxyquinazolin-4-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(7-methoxyquinazolin-4-yl)amino]methylene]malonate Formula: C13H9N3O5-2 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC=N2)NC=C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC=N2)NC=C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H11N3O5/c1-21-7-2-3-8-10(4-7)15-6-16-11(8)14-5-9(12(17)18)13(19)20/h2-6H,1H3,(H,17,18)(H,19,20)(H,14,15,16)/p-2