3-[[4-(2-chloranylpyridin-4-yl)pyrimidin-2-yl]amino]benzoic acid

Systemtic Name: 3-[[4-(2-chloranylpyridin-4-yl)pyrimidin-2-yl]amino]benzoic acid Openeye Name: 3-[[4-(2-chloro-4-pyridyl)pyrimidin-2-yl]amino]benzoic acid CAS Name: 3-[[4-(2-chloro-4-pyridinyl)-2-pyrimidinyl]amino]benzoic acid IUPAC Name: 3-[[4-(2-chloropyridin-4-yl)pyrimidin-2-yl]amino]benzoic acid Traditional Name: 3-[[4-(2-chloro-4-pyridyl)pyrimidin-2-yl]amino]benzoic acid Formula: C16H11ClN4O2 MolecularWeight: 326.73714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)Cl)C(=O)O

InChI

InChI=1S/C16H11ClN4O2/c17-14-9-10(4-6-18-14)13-5-7-19-16(21-13)20-12-3-1-2-11(8-12)15(22)23/h1-9H,(H,22,23)(H,19,20,21)