4-[(6-methoxyquinazolin-4-yl)amino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[(6-methoxyquinazolin-4-yl)amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[(6-methoxyquinazolin-4-yl)amino]benzoic acid CAS Name: 2-hydroxy-4-[(6-methoxy-4-quinazolinyl)amino]benzoic acid IUPAC Name: 2-hydroxy-4-[(6-methoxyquinazolin-4-yl)amino]benzoic acid Traditional Name: 2-hydroxy-4-[(6-methoxyquinazolin-4-yl)amino]benzoic acid Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)C(=O)O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)C(=O)O)O

InChI

InChI=1S/C16H13N3O4/c1-23-10-3-5-13-12(7-10)15(18-8-17-13)19-9-2-4-11(16(21)22)14(20)6-9/h2-8,20H,1H3,(H,21,22)(H,17,18,19)