(4S,6S)-2,2,6-trimethyl-4-(phenylmethoxymethyl)-1,3-dioxane-4-carbonitrile

Systemtic Name: (4S,6S)-2,2,6-trimethyl-4-(phenylmethoxymethyl)-1,3-dioxane-4-carbonitrile Openeye Name: (4S,6S)-4-(benzyloxymethyl)-2,2,6-trimethyl-1,3-dioxane-4-carbonitrile CAS Name: (4S,6S)-2,2,6-trimethyl-4-(phenylmethoxymethyl)-1,3-dioxane-4-carbonitrile IUPAC Name: (4S,6S)-2,2,6-trimethyl-4-(phenylmethoxymethyl)-1,3-dioxane-4-carbonitrile Traditional Name: (4S,6S)-4-(benzoxymethyl)-2,2,6-trimethyl-1,3-dioxane-4-carbonitrile Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(OC(O1)(C)C)(COCC2=CC=CC=C2)C#N

Isomeric SMILES

C[C@H]1C[C@@](OC(O1)(C)C)(COCC2=CC=CC=C2)C#N

InChI

InChI=1S/C16H21NO3/c1-13-9-16(11-17,20-15(2,3)19-13)12-18-10-14-7-5-4-6-8-14/h4-8,13H,9-10,12H2,1-3H3/t13-,16-/m0/s1