3-[(2-pyridin-4-ylquinazolin-4-yl)amino]benzoic acid

Systemtic Name: 3-[(2-pyridin-4-ylquinazolin-4-yl)amino]benzoic acid Openeye Name: 3-[[2-(4-pyridyl)quinazolin-4-yl]amino]benzoic acid CAS Name: 3-[(2-pyridin-4-yl-4-quinazolinyl)amino]benzoic acid IUPAC Name: 3-[(2-pyridin-4-ylquinazolin-4-yl)amino]benzoic acid Traditional Name: 3-[[2-(4-pyridyl)quinazolin-4-yl]amino]benzoic acid Formula: C20H14N4O2 MolecularWeight: 342.35076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=NC=C3)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=NC=C3)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C20H14N4O2/c25-20(26)14-4-3-5-15(12-14)22-19-16-6-1-2-7-17(16)23-18(24-19)13-8-10-21-11-9-13/h1-12H,(H,25,26)(H,22,23,24)