7-methyl-5-[(phenethylamino)methyl]-2-[[4-(trifluoromethyloxy)phenyl]methyl]-3H-isoindol-1-one

Systemtic Name: 7-methyl-5-[(phenethylamino)methyl]-2-[[4-(trifluoromethyloxy)phenyl]methyl]-3H-isoindol-1-one Openeye Name: 7-methyl-5-[(phenethylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]isoindolin-1-one CAS Name: 7-methyl-5-[(phenethylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one IUPAC Name: 7-methyl-5-[(phenethylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one Traditional Name: 7-methyl-5-[(phenethylamino)methyl]-2-[4-(trifluoromethoxy)benzyl]isoindolin-1-one Formula: C26H25F3N2O2 MolecularWeight: 454.48411

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)CNCCC3=CC=CC=C3)CN(C2=O)CC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

CC1=C2C(=CC(=C1)CNCCC3=CC=CC=C3)CN(C2=O)CC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C26H25F3N2O2/c1-18-13-21(15-30-12-11-19-5-3-2-4-6-19)14-22-17-31(25(32)24(18)22)16-20-7-9-23(10-8-20)33-26(27,28)29/h2-10,13-14,30H,11-12,15-17H2,1H3