4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]pyridine-2-carboxylic acid

Systemtic Name: 4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]pyridine-2-carboxylic acid Openeye Name: 4-[2-(3-chloroanilino)pyrimidin-4-yl]pyridine-2-carboxylic acid CAS Name: 4-[2-(3-chloroanilino)-4-pyrimidinyl]-2-pyridinecarboxylic acid IUPAC Name: 4-[2-(3-chloroanilino)pyrimidin-4-yl]pyridine-2-carboxylic acid Traditional Name: 4-[2-(3-chloroanilino)pyrimidin-4-yl]picolinic acid Formula: C16H11ClN4O2 MolecularWeight: 326.73714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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