[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate CAS Name: (E)-3-(2-quinoxalinyl)-2-propenoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate Traditional Name: (E)-3-quinoxalin-2-ylacrylic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C=CC2=NC3=CC=CC=C3N=C2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)/C=C/C2=NC3=CC=CC=C3N=C2)C)C

InChI

InChI=1S/C22H20N2O3/c1-14-10-16(3)18(11-15(14)2)21(25)13-27-22(26)9-8-17-12-23-19-6-4-5-7-20(19)24-17/h4-12H,13H2,1-3H3/b9-8+