5-chloranyl-2-methoxy-4-[(2-phenylquinazolin-4-yl)amino]benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-[(2-phenylquinazolin-4-yl)amino]benzoic acid Openeye Name: 5-chloro-2-methoxy-4-[(2-phenylquinazolin-4-yl)amino]benzoic acid CAS Name: 5-chloro-2-methoxy-4-[(2-phenyl-4-quinazolinyl)amino]benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-[(2-phenylquinazolin-4-yl)amino]benzoic acid Traditional Name: 5-chloro-2-methoxy-4-[(2-phenylquinazolin-4-yl)amino]benzoic acid Formula: C22H16ClN3O3 MolecularWeight: 405.83374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)O)Cl)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)O)Cl)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H16ClN3O3/c1-29-19-12-18(16(23)11-15(19)22(27)28)25-21-14-9-5-6-10-17(14)24-20(26-21)13-7-3-2-4-8-13/h2-12H,1H3,(H,27,28)(H,24,25,26)