(1,1-dideuterio-5,5-dimethoxy-3-methyl-3-oxidanyl-pentyl) ethanoate

Systemtic Name: (1,1-dideuterio-5,5-dimethoxy-3-methyl-3-oxidanyl-pentyl) ethanoate Openeye Name: (1,1-dideuterio-3-hydroxy-5,5-dimethoxy-3-methyl-pentyl) acetate CAS Name: acetic acid (1,1-dideuterio-3-hydroxy-5,5-dimethoxy-3-methylpentyl) ester IUPAC Name: (1,1-dideuterio-3-hydroxy-5,5-dimethoxy-3-methylpentyl) acetate Traditional Name: acetic acid (1,1-dideuterio-3-hydroxy-5,5-dimethoxy-3-methyl-pentyl) ester Formula: C10H20O5 MolecularWeight: 223.267778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC(C)(CC(OC)OC)O

Isomeric SMILES

[2H][13C]([2H])(CC(C)(CC(OC)OC)O)OC(=O)C

InChI

InChI=1S/C10H20O5/c1-8(11)15-6-5-10(2,12)7-9(13-3)14-4/h9,12H,5-7H2,1-4H3/i6+1D2