[1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: [1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: 2-(benzenesulfonamido)-3-methylbutanoic acid [1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: 2-(benzenesulfonamido)-3-methyl-butyric acid [2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl] ester Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C(=O)N1CC(=O)NC2=CC=CC=C21)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OC(C)C(=O)N1CC(=O)NC2=CC=CC=C21)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O6S/c1-14(2)20(24-32(29,30)16-9-5-4-6-10-16)22(28)31-15(3)21(27)25-13-19(26)23-17-11-7-8-12-18(17)25/h4-12,14-15,20,24H,13H2,1-3H3,(H,23,26)