2-[(4R,5R)-2,2-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1,3-dioxan-5-yl]ethanenitrile

Systemtic Name: 2-[(4R,5R)-2,2-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1,3-dioxan-5-yl]ethanenitrile Openeye Name: 2-[(4R,5R)-4-[(E)-cinnamyl]-2,2-dimethyl-1,3-dioxan-5-yl]acetonitrile CAS Name: 2-[(4R,5R)-2,2-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1,3-dioxan-5-yl]acetonitrile IUPAC Name: 2-[(4R,5R)-2,2-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1,3-dioxan-5-yl]acetonitrile Traditional Name: 2-[(4R,5R)-4-[(E)-cinnamyl]-2,2-dimethyl-1,3-dioxan-5-yl]acetonitrile Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(O1)CC=CC2=CC=CC=C2)CC#N)C

Isomeric SMILES

CC1(OC[C@H]([C@H](O1)C/C=C/C2=CC=CC=C2)CC#N)C

InChI

InChI=1S/C17H21NO2/c1-17(2)19-13-15(11-12-18)16(20-17)10-6-9-14-7-4-3-5-8-14/h3-9,15-16H,10-11,13H2,1-2H3/b9-6+/t15-,16-/m1/s1