5-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]-2-oxidanyl-benzoate

Systemtic Name: 5-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]-2-oxidanyl-benzoate Openeye Name: 5-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]-2-hydroxy-benzoate CAS Name: 5-[(6-bromo-4-phenyl-2-quinazolinyl)amino]-2-hydroxybenzoate IUPAC Name: 5-[(6-bromo-4-phenylquinazolin-2-yl)amino]-2-hydroxybenzoate Traditional Name: 5-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]-2-hydroxy-benzoate Formula: C21H13BrN3O3- MolecularWeight: 435.25022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NC4=CC(=C(C=C4)O)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NC4=CC(=C(C=C4)O)C(=O)[O-]

InChI

InChI=1S/C21H14BrN3O3/c22-13-6-8-17-15(10-13)19(12-4-2-1-3-5-12)25-21(24-17)23-14-7-9-18(26)16(11-14)20(27)28/h1-11,26H,(H,27,28)(H,23,24,25)/p-1