[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 3-(3-oxo-4H-quinoxalin-2-yl)propanoate CAS Name: 3-(3-oxo-4H-quinoxalin-2-yl)propanoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 3-(3-oxo-4H-quinoxalin-2-yl)propanoate Traditional Name: 3-(3-keto-4H-quinoxalin-2-yl)propionic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC2=NC3=CC=CC=C3NC2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC2=NC3=CC=CC=C3NC2=O)C

InChI

InChI=1S/C21H20N2O4/c1-13-7-8-15(11-14(13)2)19(24)12-27-20(25)10-9-18-21(26)23-17-6-4-3-5-16(17)22-18/h3-8,11H,9-10,12H2,1-2H3,(H,23,26)