3-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)propanenitrile

Systemtic Name: 3-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)propanenitrile Openeye Name: 3-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)propanenitrile CAS Name: 3-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)propanenitrile IUPAC Name: 3-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)propanenitrile Traditional Name: 3-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)propionitrile Formula: C9H14N2O4 MolecularWeight: 214.21846

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(CCC#N)[N+](=O)[O-])C

Isomeric SMILES

CC1(OCC(CO1)(CCC#N)[N+](=O)[O-])C

InChI

InChI=1S/C9H14N2O4/c1-8(2)14-6-9(7-15-8,11(12)13)4-3-5-10/h3-4,6-7H2,1-2H3