2-[[(2-methylquinazolin-4-yl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(2-methylquinazolin-4-yl)amino]methylidene]propanedioic acid Openeye Name: 2-[[(2-methylquinazolin-4-yl)amino]methylene]propanedioic acid CAS Name: 2-[[(2-methyl-4-quinazolinyl)amino]methylidene]propanedioic acid IUPAC Name: 2-[[(2-methylquinazolin-4-yl)amino]methylidene]propanedioic acid Traditional Name: 2-[[(2-methylquinazolin-4-yl)amino]methylene]malonic acid Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H11N3O4/c1-7-15-10-5-3-2-4-8(10)11(16-7)14-6-9(12(17)18)13(19)20/h2-6H,1H3,(H,17,18)(H,19,20)(H,14,15,16)