2-(2,2-diethoxyethyl)-4,4-diethoxy-2-[3-(trifluoromethyl)phenyl]butanenitrile

Systemtic Name: 2-(2,2-diethoxyethyl)-4,4-diethoxy-2-[3-(trifluoromethyl)phenyl]butanenitrile Openeye Name: 2-(2,2-diethoxyethyl)-4,4-diethoxy-2-[3-(trifluoromethyl)phenyl]butanenitrile CAS Name: 2-(2,2-diethoxyethyl)-4,4-diethoxy-2-[3-(trifluoromethyl)phenyl]butanenitrile IUPAC Name: 2-(2,2-diethoxyethyl)-4,4-diethoxy-2-[3-(trifluoromethyl)phenyl]butanenitrile Traditional Name: 2-(2,2-diethoxyethyl)-4,4-diethoxy-2-[3-(trifluoromethyl)phenyl]butyronitrile Formula: C21H30F3NO4 MolecularWeight: 417.46241

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(CC(OCC)OCC)(C#N)C1=CC(=CC=C1)C(F)(F)F)OCC

Isomeric SMILES

CCOC(CC(CC(OCC)OCC)(C#N)C1=CC(=CC=C1)C(F)(F)F)OCC

InChI

InChI=1S/C21H30F3NO4/c1-5-26-18(27-6-2)13-20(15-25,14-19(28-7-3)29-8-4)16-10-9-11-17(12-16)21(22,23)24/h9-12,18-19H,5-8,13-14H2,1-4H3