[2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: [2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: [2-methoxy-4-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenyl] 3-(6-bromo-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)propanoic acid [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] 3-(6-bromo-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)propionic acid [4-[(E)-3-keto-3-methoxy-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C22H19BrN2O6 MolecularWeight: 487.30006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OC)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OC)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C22H19BrN2O6/c1-29-19-11-14(4-8-20(26)30-2)3-7-18(19)31-21(27)9-10-25-13-24-17-6-5-15(23)12-16(17)22(25)28/h3-8,11-13H,9-10H2,1-2H3/b8-4+