3-[6-methyl-2-(methylamino)pyrimidin-4-yl]benzoic acid

Systemtic Name: 3-[6-methyl-2-(methylamino)pyrimidin-4-yl]benzoic acid Openeye Name: 3-[6-methyl-2-(methylamino)pyrimidin-4-yl]benzoic acid CAS Name: 3-[6-methyl-2-(methylamino)-4-pyrimidinyl]benzoic acid IUPAC Name: 3-[6-methyl-2-(methylamino)pyrimidin-4-yl]benzoic acid Traditional Name: 3-[6-methyl-2-(methylamino)pyrimidin-4-yl]benzoic acid Formula: C13H13N3O2 MolecularWeight: 243.26122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC(=CC=C2)C(=O)O)NC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC(=CC=C2)C(=O)O)NC

InChI

InChI=1S/C13H13N3O2/c1-8-6-11(16-13(14-2)15-8)9-4-3-5-10(7-9)12(17)18/h3-7H,1-2H3,(H,17,18)(H,14,15,16)