(4-cyanophenyl) 2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoate

Systemtic Name: (4-cyanophenyl) 2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoate Openeye Name: (4-cyanophenyl) 2-(6-bromo-4-oxo-quinazolin-3-yl)acetate CAS Name: 2-(6-bromo-4-oxo-3-quinazolinyl)acetic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 2-(6-bromo-4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(6-bromo-4-keto-quinazolin-3-yl)acetic acid (4-cyanophenyl) ester Formula: C17H10BrN3O3 MolecularWeight: 384.1836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1C#N)OC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C17H10BrN3O3/c18-12-3-6-15-14(7-12)17(23)21(10-20-15)9-16(22)24-13-4-1-11(8-19)2-5-13/h1-7,10H,9H2