2-phenylmethoxy-2-(trifluoromethyl)nonanenitrile

Systemtic Name: 2-phenylmethoxy-2-(trifluoromethyl)nonanenitrile Openeye Name: 2-benzyloxy-2-(trifluoromethyl)nonanenitrile CAS Name: 2-phenylmethoxy-2-(trifluoromethyl)nonanenitrile IUPAC Name: 2-phenylmethoxy-2-(trifluoromethyl)nonanenitrile Traditional Name: 2-benzoxy-2-(trifluoromethyl)pelargononitrile Formula: C17H22F3NO MolecularWeight: 313.35789

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C#N)(C(F)(F)F)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC(C#N)(C(F)(F)F)OCC1=CC=CC=C1

InChI

InChI=1S/C17H22F3NO/c1-2-3-4-5-9-12-16(14-21,17(18,19)20)22-13-15-10-7-6-8-11-15/h6-8,10-11H,2-5,9,12-13H2,1H3