[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C)C

InChI

InChI=1S/C22H21N3O4/c1-4-21(27)25-17-8-5-15(6-9-17)20(26)12-29-22(28)16-7-10-18-19(11-16)24-14(3)13(2)23-18/h5-11H,4,12H2,1-3H3,(H,25,27)