N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C20H20F3N3O4S MolecularWeight: 455.45071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O4S/c1-12(27)24-15-6-7-17(16(11-15)20(21,22)23)25-19(28)14-5-8-18-13(10-14)4-3-9-26(18)31(2,29)30/h5-8,10-11H,3-4,9H2,1-2H3,(H,24,27)(H,25,28)