(4S,5S)-2,2-dimethyl-5-(phenylmethyl)-1,3-dioxolane-4-carbonitrile

Systemtic Name: (4S,5S)-2,2-dimethyl-5-(phenylmethyl)-1,3-dioxolane-4-carbonitrile Openeye Name: (4S,5S)-5-benzyl-2,2-dimethyl-1,3-dioxolane-4-carbonitrile CAS Name: (4S,5S)-2,2-dimethyl-5-(phenylmethyl)-1,3-dioxolane-4-carbonitrile IUPAC Name: (4S,5S)-5-benzyl-2,2-dimethyl-1,3-dioxolane-4-carbonitrile Traditional Name: (4S,5S)-5-benzyl-2,2-dimethyl-1,3-dioxolane-4-carbonitrile Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1(O[C@H]([C@@H](O1)C#N)CC2=CC=CC=C2)C

InChI

InChI=1S/C13H15NO2/c1-13(2)15-11(12(9-14)16-13)8-10-6-4-3-5-7-10/h3-7,11-12H,8H2,1-2H3/t11-,12-/m0/s1