[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl] (E)-3-(4-bromophenyl)prop-2-enoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl] (E)-3-(4-bromophenyl)prop-2-enoate Openeye Name: [2-(3,4-dimethoxyphenyl)-4-oxo-quinazolin-3-yl] (E)-3-(4-bromophenyl)prop-2-enoate CAS Name: (E)-3-(4-bromophenyl)-2-propenoic acid [2-(3,4-dimethoxyphenyl)-4-oxo-3-quinazolinyl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-4-oxoquinazolin-3-yl] (E)-3-(4-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(4-bromophenyl)acrylic acid [2-(3,4-dimethoxyphenyl)-4-keto-quinazolin-3-yl] ester Formula: C25H19BrN2O5 MolecularWeight: 507.33276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2OC(=O)C=CC4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2OC(=O)/C=C/C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C25H19BrN2O5/c1-31-21-13-10-17(15-22(21)32-2)24-27-20-6-4-3-5-19(20)25(30)28(24)33-23(29)14-9-16-7-11-18(26)12-8-16/h3-15H,1-2H3/b14-9+