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

Systemtic Name: 2-[(2S,4R,6R)-2-methyl-6-(2-oxidanylideneethyl)-1,3-dioxan-4-yl]ethanenitrile Openeye Name: 2-[(2S,4R,6R)-2-methyl-6-(2-oxoethyl)-1,3-dioxan-4-yl]acetonitrile CAS Name: 2-[(2S,4R,6R)-2-methyl-6-(2-oxoethyl)-1,3-dioxan-4-yl]acetonitrile IUPAC Name: 2-[(2S,4R,6R)-2-methyl-6-(2-oxoethyl)-1,3-dioxan-4-yl]acetonitrile Traditional Name: 2-[(2S,4R,6R)-6-(2-ketoethyl)-2-methyl-1,3-dioxan-4-yl]acetonitrile Formula: C9H13NO3 MolecularWeight: 183.20442

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Descriptors Computed from Structure

Canonical SMILES:

CC1OC(CC(O1)CC#N)CC=O

Isomeric SMILES

C[C@@H]1O[C@H](C[C@H](O1)CC#N)CC=O

InChI

InChI=1S/C9H13NO3/c1-7-12-8(2-4-10)6-9(13-7)3-5-11/h5,7-9H,2-3,6H2,1H3/t7-,8+,9-/m0/s1