ethyl 4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]benzoate

Systemtic Name: ethyl 4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]benzoate Openeye Name: ethyl 4-[3-(6-bromo-4-oxo-quinazolin-3-yl)propanoylamino]benzoate CAS Name: 4-[[3-(6-bromo-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(6-bromo-4-oxoquinazolin-3-yl)propanoylamino]benzoate Traditional Name: 4-[3-(6-bromo-4-keto-quinazolin-3-yl)propanoylamino]benzoic acid ethyl ester Formula: C20H18BrN3O4 MolecularWeight: 444.27862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C20H18BrN3O4/c1-2-28-20(27)13-3-6-15(7-4-13)23-18(25)9-10-24-12-22-17-8-5-14(21)11-16(17)19(24)26/h3-8,11-12H,2,9-10H2,1H3,(H,23,25)