3-oxidanylidene-2-(1-propanoylpiperidin-4-yl)-N-[[4-(trifluoromethyloxy)phenyl]methyl]-1H-isoindole-1-carboxamide

Systemtic Name: 3-oxidanylidene-2-(1-propanoylpiperidin-4-yl)-N-[[4-(trifluoromethyloxy)phenyl]methyl]-1H-isoindole-1-carboxamide Openeye Name: 3-oxo-2-(1-propanoyl-4-piperidyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]isoindoline-1-carboxamide CAS Name: 3-oxo-2-[1-(1-oxopropyl)-4-piperidinyl]-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-isoindole-1-carboxamide IUPAC Name: 3-oxo-2-(1-propanoylpiperidin-4-yl)-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-isoindole-1-carboxamide Traditional Name: 3-keto-2-(1-propionyl-4-piperidyl)-N-[4-(trifluoromethoxy)benzyl]isoindoline-1-carboxamide Formula: C25H26F3N3O4 MolecularWeight: 489.48685

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1)N2C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

CCC(=O)N1CCC(CC1)N2C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C25H26F3N3O4/c1-2-21(32)30-13-11-17(12-14-30)31-22(19-5-3-4-6-20(19)24(31)34)23(33)29-15-16-7-9-18(10-8-16)35-25(26,27)28/h3-10,17,22H,2,11-15H2,1H3,(H,29,33)