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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO4/c1-9(2)16-12(15)8-11-7-10(5-6-14)17-13(3,4)18-11/h9-11H,5,7-8H2,1-4H3/t10-,11-/m0/s1