naphthalen-2-yl 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: naphthalen-2-yl 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: 2-naphthyl 3-(6-bromo-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)propanoic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 3-(6-bromo-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)propionic acid 2-naphthyl ester Formula: C21H15BrN2O3 MolecularWeight: 423.2594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H15BrN2O3/c22-16-6-8-19-18(12-16)21(26)24(13-23-19)10-9-20(25)27-17-7-5-14-3-1-2-4-15(14)11-17/h1-8,11-13H,9-10H2