2-(2,3-dihydroindol-1-ylmethyl)-5-[[4-(trifluoromethyl)phenyl]methoxy]pyran-4-one

Systemtic Name: 2-(2,3-dihydroindol-1-ylmethyl)-5-[[4-(trifluoromethyl)phenyl]methoxy]pyran-4-one Openeye Name: 2-(indolin-1-ylmethyl)-5-[[4-(trifluoromethyl)phenyl]methoxy]pyran-4-one CAS Name: 2-(2,3-dihydroindol-1-ylmethyl)-5-[[4-(trifluoromethyl)phenyl]methoxy]-4-pyranone IUPAC Name: 2-(2,3-dihydroindol-1-ylmethyl)-5-[[4-(trifluoromethyl)phenyl]methoxy]pyran-4-one Traditional Name: 2-(indolin-1-ylmethyl)-5-[4-(trifluoromethyl)benzyl]oxy-pyran-4-one Formula: C22H18F3NO3 MolecularWeight: 401.37843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)CC3=CC(=O)C(=CO3)OCC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(C2=CC=CC=C21)CC3=CC(=O)C(=CO3)OCC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H18F3NO3/c23-22(24,25)17-7-5-15(6-8-17)13-29-21-14-28-18(11-20(21)27)12-26-10-9-16-3-1-2-4-19(16)26/h1-8,11,14H,9-10,12-13H2