2-[(3,4-dimethoxyphenyl)methylamino]pyrimidine-5-carboxylic acid

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methylamino]pyrimidine-5-carboxylic acid Openeye Name: 2-[(3,4-dimethoxyphenyl)methylamino]pyrimidine-5-carboxylic acid CAS Name: 2-[(3,4-dimethoxyphenyl)methylamino]-5-pyrimidinecarboxylic acid IUPAC Name: 2-[(3,4-dimethoxyphenyl)methylamino]pyrimidine-5-carboxylic acid Traditional Name: 2-(veratrylamino)pyrimidine-5-carboxylic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NC=C(C=N2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC=C(C=N2)C(=O)O)OC

InChI

InChI=1S/C14H15N3O4/c1-20-11-4-3-9(5-12(11)21-2)6-15-14-16-7-10(8-17-14)13(18)19/h3-5,7-8H,6H2,1-2H3,(H,18,19)(H,15,16,17)