2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-methyl-benzoic acid

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-methyl-benzoic acid Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-methyl-benzoic acid CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)amino]-5-methylbenzoic acid IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-methylbenzoic acid Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-methyl-benzoic acid Formula: C14H15N3O2 MolecularWeight: 257.2878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NC(=CC(=N2)C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NC(=CC(=N2)C)C)C(=O)O

InChI

InChI=1S/C14H15N3O2/c1-8-4-5-12(11(6-8)13(18)19)17-14-15-9(2)7-10(3)16-14/h4-7H,1-3H3,(H,18,19)(H,15,16,17)