(3S,4S,6R)-2-oxidanylidene-4-phenyl-6-propan-2-yloxy-6-(trifluoromethyl)piperidine-3-carbonitrile

Systemtic Name: (3S,4S,6R)-2-oxidanylidene-4-phenyl-6-propan-2-yloxy-6-(trifluoromethyl)piperidine-3-carbonitrile Openeye Name: (3S,4S,6R)-6-isopropoxy-2-oxo-4-phenyl-6-(trifluoromethyl)piperidine-3-carbonitrile CAS Name: (3S,4S,6R)-2-oxo-4-phenyl-6-propan-2-yloxy-6-(trifluoromethyl)-3-piperidinecarbonitrile IUPAC Name: (3S,4S,6R)-2-oxo-4-phenyl-6-propan-2-yloxy-6-(trifluoromethyl)piperidine-3-carbonitrile Traditional Name: (3S,4S,6R)-6-isopropoxy-2-keto-4-phenyl-6-(trifluoromethyl)nipecotonitrile Formula: C16H17F3N2O2 MolecularWeight: 326.31359

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1(CC(C(C(=O)N1)C#N)C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CC(C)O[C@]1(C[C@@H]([C@H](C(=O)N1)C#N)C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C16H17F3N2O2/c1-10(2)23-15(16(17,18)19)8-12(11-6-4-3-5-7-11)13(9-20)14(22)21-15/h3-7,10,12-13H,8H2,1-2H3,(H,21,22)/t12-,13-,15-/m1/s1