3,3-dimethyl-1-(2-oxidanylidenepyrrolidin-1-yl)-7-(phenylsulfonyl)-2H-quinolin-4-one

Systemtic Name: 3,3-dimethyl-1-(2-oxidanylidenepyrrolidin-1-yl)-7-(phenylsulfonyl)-2H-quinolin-4-one Openeye Name: 7-(benzenesulfonyl)-3,3-dimethyl-1-(2-oxopyrrolidin-1-yl)-2H-quinolin-4-one CAS Name: 7-(benzenesulfonyl)-3,3-dimethyl-1-(2-oxo-1-pyrrolidinyl)-2H-quinolin-4-one IUPAC Name: 7-(benzenesulfonyl)-3,3-dimethyl-1-(2-oxopyrrolidin-1-yl)-2H-quinolin-4-one Traditional Name: 7-besyl-1-(2-ketopyrrolidino)-3,3-dimethyl-2H-quinolin-4-one Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C(C1=O)C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)N4CCCC4=O)C

Isomeric SMILES

CC1(CN(C2=C(C1=O)C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)N4CCCC4=O)C

InChI

InChI=1S/C21H22N2O4S/c1-21(2)14-23(22-12-6-9-19(22)24)18-13-16(10-11-17(18)20(21)25)28(26,27)15-7-4-3-5-8-15/h3-5,7-8,10-11,13H,6,9,12,14H2,1-2H3