N-(cyanomethyl)-2-[2-[4-(trifluoromethyloxy)phenyl]phenyl]cyclohexane-1-carboxamide

Systemtic Name: N-(cyanomethyl)-2-[2-[4-(trifluoromethyloxy)phenyl]phenyl]cyclohexane-1-carboxamide Openeye Name: N-(cyanomethyl)-2-[2-[4-(trifluoromethoxy)phenyl]phenyl]cyclohexanecarboxamide CAS Name: N-(cyanomethyl)-2-[2-[4-(trifluoromethoxy)phenyl]phenyl]-1-cyclohexanecarboxamide IUPAC Name: N-(cyanomethyl)-2-[2-[4-(trifluoromethoxy)phenyl]phenyl]cyclohexane-1-carboxamide Traditional Name: N-(cyanomethyl)-2-[2-[4-(trifluoromethoxy)phenyl]phenyl]cyclohexanecarboxamide Formula: C22H21F3N2O2 MolecularWeight: 402.40955

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=CC=CC=C2C3=CC=C(C=C3)OC(F)(F)F)C(=O)NCC#N

Isomeric SMILES

C1CCC(C(C1)C2=CC=CC=C2C3=CC=C(C=C3)OC(F)(F)F)C(=O)NCC#N

InChI

InChI=1S/C22H21F3N2O2/c23-22(24,25)29-16-11-9-15(10-12-16)17-5-1-2-6-18(17)19-7-3-4-8-20(19)21(28)27-14-13-26/h1-2,5-6,9-12,19-20H,3-4,7-8,14H2,(H,27,28)