N-[3,3-dimethyl-4-oxidanylidene-7-(phenylsulfonyl)-2H-quinolin-1-yl]-N-methyl-propanamide

Systemtic Name: N-[3,3-dimethyl-4-oxidanylidene-7-(phenylsulfonyl)-2H-quinolin-1-yl]-N-methyl-propanamide Openeye Name: N-[7-(benzenesulfonyl)-3,3-dimethyl-4-oxo-2H-quinolin-1-yl]-N-methyl-propanamide CAS Name: N-[7-(benzenesulfonyl)-3,3-dimethyl-4-oxo-2H-quinolin-1-yl]-N-methylpropanamide IUPAC Name: N-[7-(benzenesulfonyl)-3,3-dimethyl-4-oxo-2H-quinolin-1-yl]-N-methylpropanamide Traditional Name: N-(7-besyl-4-keto-3,3-dimethyl-2H-quinolin-1-yl)-N-methyl-propionamide Formula: C21H24N2O4S MolecularWeight: 400.49126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C)N1CC(C(=O)C2=C1C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)(C)C

Isomeric SMILES

CCC(=O)N(C)N1CC(C(=O)C2=C1C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)(C)C

InChI

InChI=1S/C21H24N2O4S/c1-5-19(24)22(4)23-14-21(2,3)20(25)17-12-11-16(13-18(17)23)28(26,27)15-9-7-6-8-10-15/h6-13H,5,14H2,1-4H3