(2-chloranyl-4-cyano-phenyl) 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: (2-chloro-4-cyano-phenyl) 3-(6-bromo-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)propanoic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 3-(6-bromo-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)propionic acid (2-chloro-4-cyano-phenyl) ester Formula: C18H11BrClN3O3 MolecularWeight: 432.65524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)Cl)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CC(=C(C=C1C#N)Cl)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H11BrClN3O3/c19-12-2-3-15-13(8-12)18(25)23(10-22-15)6-5-17(24)26-16-4-1-11(9-21)7-14(16)20/h1-4,7-8,10H,5-6H2