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

Systemtic Name: 7-methyl-5-[(3-phenylpropylamino)methyl]-2-[[4-(trifluoromethyloxy)phenyl]methyl]-3H-isoindol-1-one Openeye Name: 7-methyl-5-[(3-phenylpropylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]isoindolin-1-one CAS Name: 7-methyl-5-[(3-phenylpropylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one IUPAC Name: 7-methyl-5-[(3-phenylpropylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one Traditional Name: 7-methyl-5-[(3-phenylpropylamino)methyl]-2-[4-(trifluoromethoxy)benzyl]isoindolin-1-one Formula: C27H27F3N2O2 MolecularWeight: 468.51069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)CNCCCC3=CC=CC=C3)CN(C2=O)CC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

CC1=C2C(=CC(=C1)CNCCCC3=CC=CC=C3)CN(C2=O)CC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C27H27F3N2O2/c1-19-14-22(16-31-13-5-8-20-6-3-2-4-7-20)15-23-18-32(26(33)25(19)23)17-21-9-11-24(12-10-21)34-27(28,29)30/h2-4,6-7,9-12,14-15,31H,5,8,13,16-18H2,1H3