[4-[1-[2,3-dimethyl-4-[2-[(2-methylcyclohexyl)amino]ethoxy]phenyl]ethyl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-[1-[2,3-dimethyl-4-[2-[(2-methylcyclohexyl)amino]ethoxy]phenyl]ethyl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone Openeye Name: [4-[1-[2,3-dimethyl-4-[2-[(2-methylcyclohexyl)amino]ethoxy]phenyl]ethyl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone CAS Name: [4-[1-[2,3-dimethyl-4-[2-[(2-methylcyclohexyl)amino]ethoxy]phenyl]ethyl]-1-piperazinyl]-[4-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-[1-[2,3-dimethyl-4-[2-[(2-methylcyclohexyl)amino]ethoxy]phenyl]ethyl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone Traditional Name: [4-[1-[2,3-dimethyl-4-[2-[(2-methylcyclohexyl)amino]ethoxy]phenyl]ethyl]piperazino]-[4-(trifluoromethyl)phenyl]methanone Formula: C31H42F3N3O2 MolecularWeight: 545.67929

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NCCOC2=C(C(=C(C=C2)C(C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F)C)C

Isomeric SMILES

CC1CCCCC1NCCOC2=C(C(=C(C=C2)C(C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F)C)C

InChI

InChI=1S/C31H42F3N3O2/c1-21-7-5-6-8-28(21)35-15-20-39-29-14-13-27(22(2)23(29)3)24(4)36-16-18-37(19-17-36)30(38)25-9-11-26(12-10-25)31(32,33)34/h9-14,21,24,28,35H,5-8,15-20H2,1-4H3