[1-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-1-oxidanylidene-propan-2-yl] 3-benzamidopropanoate

Systemtic Name: [1-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-1-oxidanylidene-propan-2-yl] 3-benzamidopropanoate Openeye Name: [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-methyl-2-oxo-ethyl] 3-benzamidopropanoate CAS Name: 3-benzamidopropanoic acid [1-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-oxopropan-2-yl] 3-benzamidopropanoate Traditional Name: 3-benzamidopropionic acid [2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)-1-methyl-ethyl] ester Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)OC(=O)CCNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)OC(=O)CCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O5/c1-15(31-19(27)13-14-24-20(28)16-9-5-4-6-10-16)21(29)26-18-12-8-7-11-17(18)25-22(30)23(26,2)3/h4-12,15H,13-14H2,1-3H3,(H,24,28)(H,25,30)