methyl 5-oxidanyl-3-oxidanylidene-hept-6-enoate

Systemtic Name: methyl 5-oxidanyl-3-oxidanylidene-hept-6-enoate Openeye Name: methyl 5-hydroxy-3-oxo-hept-6-enoate CAS Name: 5-hydroxy-3-oxo-6-heptenoic acid methyl ester IUPAC Name: methyl 5-hydroxy-3-oxohept-6-enoate Traditional Name: 5-hydroxy-3-keto-hept-6-enoic acid methyl ester Formula: C8H12O4 MolecularWeight: 172.17848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12O4/c1-3-6(9)4-7(10)5-8(11)12-2/h3,6,9H,1,4-5H2,2H3