2-chloranyl-4-[[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-chloranyl-4-[[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]carbamoyl]benzoic acid Openeye Name: 2-chloro-4-[[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]carbamoyl]benzoic acid CAS Name: 2-chloro-4-[[4-[(6,7-dimethoxy-4-quinazolinyl)amino]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-chloro-4-[[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]carbamoyl]benzoic acid Traditional Name: 2-chloro-4-[[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]carbamoyl]benzoic acid Formula: C24H19ClN4O5 MolecularWeight: 478.88446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)C(=O)O)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)C(=O)O)Cl)OC

InChI

InChI=1S/C24H19ClN4O5/c1-33-20-10-17-19(11-21(20)34-2)26-12-27-22(17)28-14-4-6-15(7-5-14)29-23(30)13-3-8-16(24(31)32)18(25)9-13/h3-12H,1-2H3,(H,29,30)(H,31,32)(H,26,27,28)