4-[[(4-methoxypyrimidin-2-yl)amino]methyl]benzoic acid

Systemtic Name: 4-[[(4-methoxypyrimidin-2-yl)amino]methyl]benzoic acid Openeye Name: 4-[[(4-methoxypyrimidin-2-yl)amino]methyl]benzoic acid CAS Name: 4-[[(4-methoxy-2-pyrimidinyl)amino]methyl]benzoic acid IUPAC Name: 4-[[(4-methoxypyrimidin-2-yl)amino]methyl]benzoic acid Traditional Name: 4-[[(4-methoxypyrimidin-2-yl)amino]methyl]benzoic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC1=NC(=NC=C1)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H13N3O3/c1-19-11-6-7-14-13(16-11)15-8-9-2-4-10(5-3-9)12(17)18/h2-7H,8H2,1H3,(H,17,18)(H,14,15,16)