[2-oxidanylidene-2-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)ethyl] 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: [2-oxidanylidene-2-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)ethyl] 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: [2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid [2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] ester IUPAC Name: [2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid [2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)OCC(=O)N2CC(=O)NC3=CC=CC=C32)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)OCC(=O)N2CC(=O)NC3=CC=CC=C32)OC

InChI

InChI=1S/C21H22N2O6/c1-27-15-9-14(10-16(11-15)28-2)7-8-21(26)29-13-20(25)23-12-19(24)22-17-5-3-4-6-18(17)23/h3-6,9-11H,7-8,12-13H2,1-2H3,(H,22,24)