4-[(3,4-dimethoxyphenyl)amino]pyrimidine-5-carboxylate

Systemtic Name: 4-[(3,4-dimethoxyphenyl)amino]pyrimidine-5-carboxylate Openeye Name: 4-(3,4-dimethoxyanilino)pyrimidine-5-carboxylate CAS Name: 4-(3,4-dimethoxyanilino)-5-pyrimidinecarboxylate IUPAC Name: 4-(3,4-dimethoxyanilino)pyrimidine-5-carboxylate Traditional Name: 4-(3,4-dimethoxyanilino)pyrimidine-5-carboxylate Formula: C13H12N3O4- MolecularWeight: 274.25208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=NC=C2C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=NC=C2C(=O)[O-])OC

InChI

InChI=1S/C13H13N3O4/c1-19-10-4-3-8(5-11(10)20-2)16-12-9(13(17)18)6-14-7-15-12/h3-7H,1-2H3,(H,17,18)(H,14,15,16)/p-1