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

Systemtic Name: (4-ethylphenyl) 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: (4-ethylphenyl) 3-(6-bromo-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)propanoic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) 3-(6-bromo-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)propionic acid (4-ethylphenyl) ester Formula: C19H17BrN2O3 MolecularWeight: 401.25388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O3/c1-2-13-3-6-15(7-4-13)25-18(23)9-10-22-12-21-17-8-5-14(20)11-16(17)19(22)24/h3-8,11-12H,2,9-10H2,1H3