methyl 2-[(3S,6R)-6-methoxy-6-pent-4-ynyl-1,2-dioxan-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S,6R)-6-methoxy-6-pent-4-ynyl-1,2-dioxan-3-yl]ethanoate Openeye Name: methyl 2-[(3S,6R)-6-methoxy-6-pent-4-ynyl-dioxan-3-yl]acetate CAS Name: 2-[(3S,6R)-6-methoxy-6-pent-4-ynyl-3-dioxanyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S,6R)-6-methoxy-6-pent-4-ynyldioxan-3-yl]acetate Traditional Name: 2-[(3S,6R)-6-methoxy-6-pent-4-ynyl-dioxan-3-yl]acetic acid methyl ester Formula: C13H20O5 MolecularWeight: 256.2949

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCC(OO1)(CCCC#C)OC

Isomeric SMILES

COC(=O)C[C@@H]1CC[C@](OO1)(CCCC#C)OC

InChI

InChI=1S/C13H20O5/c1-4-5-6-8-13(16-3)9-7-11(17-18-13)10-12(14)15-2/h1,11H,5-10H2,2-3H3/t11-,13+/m0/s1