propyl 2-[6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]ethanoate

Systemtic Name: propyl 2-[6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]ethanoate Openeye Name: propyl 2-[6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate CAS Name: 2-[6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetic acid propyl ester IUPAC Name: propyl 2-[6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate Traditional Name: 2-[6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetic acid propyl ester Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CC1CC(OC(O1)(C)C)CC#N

Isomeric SMILES

CCCOC(=O)CC1CC(OC(O1)(C)C)CC#N

InChI

InChI=1S/C13H21NO4/c1-4-7-16-12(15)9-11-8-10(5-6-14)17-13(2,3)18-11/h10-11H,4-5,7-9H2,1-3H3