3-[[5-(2-isocyanoethoxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]methoxy]propanenitrile

Systemtic Name: 3-[[5-(2-isocyanoethoxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]methoxy]propanenitrile Openeye Name: 3-[[5-(2-isocyanoethoxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]methoxy]propanenitrile CAS Name: 3-[[5-(2-isocyanoethoxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]methoxy]propanenitrile IUPAC Name: 3-[[5-(2-isocyanoethoxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]methoxy]propanenitrile Traditional Name: 3-[[5-(2-isocyanoethoxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]methoxy]propionitrile Formula: C14H22N2O4 MolecularWeight: 282.33548

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(COCCC#N)COCC[N+]#[C-])C

Isomeric SMILES

CC1(OCC(CO1)(COCCC#N)COCC[N+]#[C-])C

InChI

InChI=1S/C14H22N2O4/c1-13(2)19-11-14(12-20-13,9-17-7-4-5-15)10-18-8-6-16-3/h4,6-12H2,1-2H3