N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-furanyl(oxo)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2-furoyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H16ClF3N2O3 MolecularWeight: 448.82225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C22H16ClF3N2O3/c23-17-8-7-15(11-16(17)22(24,25)26)27-20(29)18-10-13-4-1-2-5-14(13)12-28(18)21(30)19-6-3-9-31-19/h1-9,11,18H,10,12H2,(H,27,29)