phenyl 4-[(6-bromanylquinazolin-4-yl)amino]-2-oxidanyl-benzoate hydrochloride

Systemtic Name: phenyl 4-[(6-bromanylquinazolin-4-yl)amino]-2-oxidanyl-benzoate hydrochloride Openeye Name: phenyl 4-[(6-bromoquinazolin-4-yl)amino]-2-hydroxy-benzoate hydrochloride CAS Name: 4-[(6-bromo-4-quinazolinyl)amino]-2-hydroxybenzoic acid phenyl ester hydrochloride IUPAC Name: phenyl 4-[(6-bromoquinazolin-4-yl)amino]-2-hydroxybenzoate hydrochloride Traditional Name: 4-[(6-bromoquinazolin-4-yl)amino]-2-hydroxy-benzoic acid phenyl ester hydrochloride Formula: C21H15BrClN3O3 MolecularWeight: 472.7191

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)Br)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)Br)O.Cl

InChI

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