methyl (E)-7-(4-oxidanylideneoxan-3-yl)hept-5-enoate

Systemtic Name: methyl (E)-7-(4-oxidanylideneoxan-3-yl)hept-5-enoate Openeye Name: methyl (E)-7-(4-oxotetrahydropyran-3-yl)hept-5-enoate CAS Name: (E)-7-(4-oxo-3-oxanyl)-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-(4-oxooxan-3-yl)hept-5-enoate Traditional Name: (E)-7-(4-ketotetrahydropyran-3-yl)hept-5-enoic acid methyl ester Formula: C13H20O4 MolecularWeight: 240.2955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=CCC1COCCC1=O

Isomeric SMILES

COC(=O)CCC/C=C/CC1COCCC1=O

InChI

InChI=1S/C13H20O4/c1-16-13(15)7-5-3-2-4-6-11-10-17-9-8-12(11)14/h2,4,11H,3,5-10H2,1H3/b4-2+