(4-iodophenyl) 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: (4-iodophenyl) 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: (4-iodophenyl) 3-(6-bromo-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)propanoic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 3-(6-bromo-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)propionic acid (4-iodophenyl) ester Formula: C17H12BrIN2O3 MolecularWeight: 499.09725

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)I

Isomeric SMILES

C1=CC(=CC=C1OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)I

InChI

InChI=1S/C17H12BrIN2O3/c18-11-1-6-15-14(9-11)17(23)21(10-20-15)8-7-16(22)24-13-4-2-12(19)3-5-13/h1-6,9-10H,7-8H2