2-cyclohexyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-cyclohexyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-cyclohexyl-5-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-cyclohexyl-5-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-cyclohexyl-5-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-cyclohexyl-5-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C26H26F3N3O3 MolecularWeight: 485.49815

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C26H26F3N3O3/c27-26(28,29)18-5-4-8-20(16-18)30-11-13-31(14-12-30)23(33)17-9-10-21-22(15-17)25(35)32(24(21)34)19-6-2-1-3-7-19/h4-5,8-10,15-16,19H,1-3,6-7,11-14H2