4-[(6-methylpyrimidin-4-yl)amino]benzoate

Systemtic Name: 4-[(6-methylpyrimidin-4-yl)amino]benzoate Openeye Name: 4-[(6-methylpyrimidin-4-yl)amino]benzoate CAS Name: 4-[(6-methyl-4-pyrimidinyl)amino]benzoate IUPAC Name: 4-[(6-methylpyrimidin-4-yl)amino]benzoate Traditional Name: 4-[(6-methylpyrimidin-4-yl)amino]benzoate Formula: C12H10N3O2- MolecularWeight: 228.2267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=NC=N1)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C12H11N3O2/c1-8-6-11(14-7-13-8)15-10-4-2-9(3-5-10)12(16)17/h2-7H,1H3,(H,16,17)(H,13,14,15)/p-1