3-(2,2-dimethyloxan-4-yl)-4-phenyl-butanenitrile

Systemtic Name: 3-(2,2-dimethyloxan-4-yl)-4-phenyl-butanenitrile Openeye Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-4-phenyl-butanenitrile CAS Name: 3-(2,2-dimethyl-4-oxanyl)-4-phenylbutanenitrile IUPAC Name: 3-(2,2-dimethyloxan-4-yl)-4-phenylbutanenitrile Traditional Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-4-phenyl-butyronitrile Formula: C17H23NO MolecularWeight: 257.37062

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(CC#N)CC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(CCO1)C(CC#N)CC2=CC=CC=C2)C

InChI

InChI=1S/C17H23NO/c1-17(2)13-16(9-11-19-17)15(8-10-18)12-14-6-4-3-5-7-14/h3-7,15-16H,8-9,11-13H2,1-2H3