2-[(1R)-3-(tert-butylamino)-1-phenyl-propoxy]-6-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[(1R)-3-(tert-butylamino)-1-phenyl-propoxy]-6-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(1R)-3-(tert-butylamino)-1-phenyl-propoxy]-6-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(1R)-3-(tert-butylamino)-1-phenylpropoxy]-6-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(1R)-3-(tert-butylamino)-1-phenylpropoxy]-6-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(1R)-3-(tert-butylamino)-1-phenyl-propoxy]-6-(trifluoromethyl)nicotinonitrile Formula: C20H22F3N3O MolecularWeight: 377.40339

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCC(C1=CC=CC=C1)OC2=C(C=CC(=N2)C(F)(F)F)C#N

Isomeric SMILES

CC(C)(C)NCC[C@H](C1=CC=CC=C1)OC2=C(C=CC(=N2)C(F)(F)F)C#N

InChI

InChI=1S/C20H22F3N3O/c1-19(2,3)25-12-11-16(14-7-5-4-6-8-14)27-18-15(13-24)9-10-17(26-18)20(21,22)23/h4-10,16,25H,11-12H2,1-3H3/t16-/m1/s1