5-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]-2-oxidanyl-benzoic acid Openeye Name: 5-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]-2-hydroxy-benzoic acid CAS Name: 5-[(2-chloro-6,7-dimethoxy-4-quinazolinyl)amino]-2-hydroxybenzoic acid IUPAC Name: 5-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]-2-hydroxybenzoic acid Traditional Name: 5-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]-2-hydroxy-benzoic acid Formula: C17H14ClN3O5 MolecularWeight: 375.76316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC3=CC(=C(C=C3)O)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC3=CC(=C(C=C3)O)C(=O)O)OC

InChI

InChI=1S/C17H14ClN3O5/c1-25-13-6-9-11(7-14(13)26-2)20-17(18)21-15(9)19-8-3-4-12(22)10(5-8)16(23)24/h3-7,22H,1-2H3,(H,23,24)(H,19,20,21)