3-[(4S,6S)-6-hexyl-2,2-dimethyl-1,3-dioxan-4-yl]propanenitrile

Systemtic Name: 3-[(4S,6S)-6-hexyl-2,2-dimethyl-1,3-dioxan-4-yl]propanenitrile Openeye Name: 3-[(4S,6S)-6-hexyl-2,2-dimethyl-1,3-dioxan-4-yl]propanenitrile CAS Name: 3-[(4S,6S)-6-hexyl-2,2-dimethyl-1,3-dioxan-4-yl]propanenitrile IUPAC Name: 3-[(4S,6S)-6-hexyl-2,2-dimethyl-1,3-dioxan-4-yl]propanenitrile Traditional Name: 3-[(4S,6S)-6-hexyl-2,2-dimethyl-1,3-dioxan-4-yl]propionitrile Formula: C15H27NO2 MolecularWeight: 253.38038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(OC(O1)(C)C)CCC#N

Isomeric SMILES

CCCCCC[C@H]1C[C@@H](OC(O1)(C)C)CCC#N

InChI

InChI=1S/C15H27NO2/c1-4-5-6-7-9-13-12-14(10-8-11-16)18-15(2,3)17-13/h13-14H,4-10,12H2,1-3H3/t13-,14-/m0/s1