4-[[4-(carboxymethyloxy)-6-methyl-pyrimidin-2-yl]amino]benzoic acid

Systemtic Name: 4-[[4-(carboxymethyloxy)-6-methyl-pyrimidin-2-yl]amino]benzoic acid Openeye Name: 4-[[4-(carboxymethyloxy)-6-methyl-pyrimidin-2-yl]amino]benzoic acid CAS Name: 4-[[4-(carboxymethyloxy)-6-methyl-2-pyrimidinyl]amino]benzoic acid IUPAC Name: 4-[[4-(carboxymethyloxy)-6-methylpyrimidin-2-yl]amino]benzoic acid Traditional Name: 4-[[4-(carboxymethyloxy)-6-methyl-pyrimidin-2-yl]amino]benzoic acid Formula: C14H13N3O5 MolecularWeight: 303.27012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C(=O)O)OCC(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C(=O)O)OCC(=O)O

InChI

InChI=1S/C14H13N3O5/c1-8-6-11(22-7-12(18)19)17-14(15-8)16-10-4-2-9(3-5-10)13(20)21/h2-6H,7H2,1H3,(H,18,19)(H,20,21)(H,15,16,17)