[2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate

Systemtic Name: [2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate Openeye Name: [2-[4-(4-bromophenyl)phenyl]-2-oxo-ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate CAS Name: (E)-3-(2-quinoxalinyl)-2-propenoic acid [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] (E)-3-quinoxalin-2-ylprop-2-enoate Traditional Name: (E)-3-quinoxalin-2-ylacrylic acid [2-[4-(4-bromophenyl)phenyl]-2-keto-ethyl] ester Formula: C25H17BrN2O3 MolecularWeight: 473.31808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)C=CC(=O)OCC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)/C=C/C(=O)OCC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H17BrN2O3/c26-20-11-9-18(10-12-20)17-5-7-19(8-6-17)24(29)16-31-25(30)14-13-21-15-27-22-3-1-2-4-23(22)28-21/h1-15H,16H2/b14-13+