methyl (3R,4R)-4-(dioxidanyl)-3-oxidanyl-hex-5-enoate

Systemtic Name: methyl (3R,4R)-4-(dioxidanyl)-3-oxidanyl-hex-5-enoate Openeye Name: methyl (3R,4R)-4-hydroperoxy-3-hydroxy-hex-5-enoate CAS Name: (3R,4R)-4-hydroperoxy-3-hydroxy-5-hexenoic acid methyl ester IUPAC Name: methyl (3R,4R)-4-hydroperoxy-3-hydroxyhex-5-enoate Traditional Name: (3R,4R)-4-hydroperoxy-3-hydroxy-hex-5-enoic acid methyl ester Formula: C7H12O5 MolecularWeight: 176.16718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(C=C)OO)O

Isomeric SMILES

COC(=O)C[C@H]([C@@H](C=C)OO)O

InChI

InChI=1S/C7H12O5/c1-3-6(12-10)5(8)4-7(9)11-2/h3,5-6,8,10H,1,4H2,2H3/t5-,6-/m1/s1