methyl (E)-2-acetyloxy-7-[2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]hept-5-enoate

Systemtic Name: methyl (E)-2-acetyloxy-7-[2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]hept-5-enoate Openeye Name: methyl (E)-2-acetoxy-7-[2-[(E)-oct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoate CAS Name: (E)-2-acetyloxy-7-[2-[(E)-oct-1-enyl]-5-oxocyclopentyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-2-acetyloxy-7-[2-[(E)-oct-1-enyl]-5-oxocyclopentyl]hept-5-enoate Traditional Name: (E)-2-acetoxy-7-[2-keto-5-[(E)-oct-1-enyl]cyclopentyl]hept-5-enoic acid methyl ester Formula: C23H36O5 MolecularWeight: 392.52894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1CCC(=O)C1CC=CCCC(C(=O)OC)OC(=O)C

Isomeric SMILES

CCCCCC/C=C/C1CCC(=O)C1C/C=C/CCC(C(=O)OC)OC(=O)C

InChI

InChI=1S/C23H36O5/c1-4-5-6-7-8-10-13-19-16-17-21(25)20(19)14-11-9-12-15-22(23(26)27-3)28-18(2)24/h9-11,13,19-20,22H,4-8,12,14-17H2,1-3H3/b11-9+,13-10+