2-chloranyl-N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(3-oxidanylpropyl)-5-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(3-oxidanylpropyl)-5-(trifluoromethyl)benzenesulfonamide Openeye Name: 2-chloro-N-(3-hydroxypropyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-5-(trifluoromethyl)benzenesulfonamide CAS Name: 2-chloro-N-(3-hydroxypropyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-5-(trifluoromethyl)benzenesulfonamide IUPAC Name: 2-chloro-N-(3-hydroxypropyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-5-(trifluoromethyl)benzenesulfonamide Traditional Name: 2-chloro-N-(3-hydroxypropyl)-N-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-5-(trifluoromethyl)benzenesulfonamide Formula: C21H20ClF3N2O5S MolecularWeight: 504.90711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C21H20ClF3N2O5S/c1-32-16-5-3-13-9-14(20(29)26-18(13)11-16)12-27(7-2-8-28)33(30,31)19-10-15(21(23,24)25)4-6-17(19)22/h3-6,9-11,28H,2,7-8,12H2,1H3,(H,26,29)