(3-bromophenyl)-(6,7-diethoxyquinazolin-4-yl)azanium chloride

Systemtic Name: (3-bromophenyl)-(6,7-diethoxyquinazolin-4-yl)azanium chloride Openeye Name: (3-bromophenyl)-(6,7-diethoxyquinazolin-4-yl)ammonium chloride CAS Name: (3-bromophenyl)-(6,7-diethoxy-4-quinazolinyl)ammonium chloride IUPAC Name: (3-bromophenyl)-(6,7-diethoxyquinazolin-4-yl)azanium chloride Traditional Name: (3-bromophenyl)-(6,7-diethoxyquinazolin-4-yl)ammonium chloride Formula: C18H19BrClN3O2 MolecularWeight: 424.71936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC=N2)[NH2+]C3=CC(=CC=C3)Br)OCC.[Cl-]

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC=N2)[NH2+]C3=CC(=CC=C3)Br)OCC.[Cl-]

InChI

InChI=1S/C18H18BrN3O2.ClH/c1-3-23-16-9-14-15(10-17(16)24-4-2)20-11-21-18(14)22-13-7-5-6-12(19)8-13;/h5-11H,3-4H2,1-2H3,(H,20,21,22);1H