2-[(2-chloranyl-5-methyl-pyrimidin-4-yl)amino]benzoate

Systemtic Name: 2-[(2-chloranyl-5-methyl-pyrimidin-4-yl)amino]benzoate Openeye Name: 2-[(2-chloro-5-methyl-pyrimidin-4-yl)amino]benzoate CAS Name: 2-[(2-chloro-5-methyl-4-pyrimidinyl)amino]benzoate IUPAC Name: 2-[(2-chloro-5-methylpyrimidin-4-yl)amino]benzoate Traditional Name: 2-[(2-chloro-5-methyl-pyrimidin-4-yl)amino]benzoate Formula: C12H9ClN3O2- MolecularWeight: 262.67176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=CC=CC=C2C(=O)[O-])Cl

Isomeric SMILES

CC1=CN=C(N=C1NC2=CC=CC=C2C(=O)[O-])Cl

InChI

InChI=1S/C12H10ClN3O2/c1-7-6-14-12(13)16-10(7)15-9-5-3-2-4-8(9)11(17)18/h2-6H,1H3,(H,17,18)(H,14,15,16)/p-1