2-[[2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]amino]benzoic acid

Systemtic Name: 2-[[2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]amino]benzoic acid Openeye Name: 2-[[2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]amino]benzoic acid CAS Name: 2-[[2-(4-chlorophenyl)-6-methyl-4-pyrimidinyl]amino]benzoic acid IUPAC Name: 2-[[2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]amino]benzoic acid Traditional Name: 2-[[2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]amino]benzoic acid Formula: C18H14ClN3O2 MolecularWeight: 339.77566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC=C(C=C2)Cl)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC=C(C=C2)Cl)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H14ClN3O2/c1-11-10-16(21-15-5-3-2-4-14(15)18(23)24)22-17(20-11)12-6-8-13(19)9-7-12/h2-10H,1H3,(H,23,24)(H,20,21,22)