2-[(2R,4S,6S)-6-(2-oxidanylideneethyl)-2-phenyl-1,3-dioxan-4-yl]ethanenitrile

Systemtic Name: 2-[(2R,4S,6S)-6-(2-oxidanylideneethyl)-2-phenyl-1,3-dioxan-4-yl]ethanenitrile Openeye Name: 2-[(2R,4S,6S)-6-(2-oxoethyl)-2-phenyl-1,3-dioxan-4-yl]acetonitrile CAS Name: 2-[(2R,4S,6S)-6-(2-oxoethyl)-2-phenyl-1,3-dioxan-4-yl]acetonitrile IUPAC Name: 2-[(2R,4S,6S)-6-(2-oxoethyl)-2-phenyl-1,3-dioxan-4-yl]acetonitrile Traditional Name: 2-[(2R,4S,6S)-6-(2-ketoethyl)-2-phenyl-1,3-dioxan-4-yl]acetonitrile Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(OC1CC#N)C2=CC=CC=C2)CC=O

Isomeric SMILES

C1[C@H](O[C@@H](O[C@H]1CC#N)C2=CC=CC=C2)CC=O

InChI

InChI=1S/C14H15NO3/c15-8-6-12-10-13(7-9-16)18-14(17-12)11-4-2-1-3-5-11/h1-5,9,12-14H,6-7,10H2/t12-,13+,14+/m0/s1