ethyl 2-[6-methylsulfonyl-3-oxidanylidene-2-(phenylmethyl)-2,4-dihydroquinoxalin-1-yl]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[6-methylsulfonyl-3-oxidanylidene-2-(phenylmethyl)-2,4-dihydroquinoxalin-1-yl]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-(2-benzyl-6-methylsulfonyl-3-oxo-2,4-dihydroquinoxalin-1-yl)-2-oxo-acetate CAS Name: 2-[6-methylsulfonyl-3-oxo-2-(phenylmethyl)-2,4-dihydroquinoxalin-1-yl]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-(2-benzyl-6-methylsulfonyl-3-oxo-2,4-dihydroquinoxalin-1-yl)-2-oxoacetate Traditional Name: 2-(2-benzyl-3-keto-6-mesyl-2,4-dihydroquinoxalin-1-yl)-2-keto-acetic acid ethyl ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)N1C(C(=O)NC2=C1C=CC(=C2)S(=O)(=O)C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(=O)N1C(C(=O)NC2=C1C=CC(=C2)S(=O)(=O)C)CC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O6S/c1-3-28-20(25)19(24)22-16-10-9-14(29(2,26)27)12-15(16)21-18(23)17(22)11-13-7-5-4-6-8-13/h4-10,12,17H,3,11H2,1-2H3,(H,21,23)