methyl (E)-7-[3-ethoxy-2-[(E)-oct-1-enyl]-5-oxidanyl-cyclopentyl]hept-5-enoate

Systemtic Name: methyl (E)-7-[3-ethoxy-2-[(E)-oct-1-enyl]-5-oxidanyl-cyclopentyl]hept-5-enoate Openeye Name: methyl (E)-7-[3-ethoxy-5-hydroxy-2-[(E)-oct-1-enyl]cyclopentyl]hept-5-enoate CAS Name: (E)-7-[3-ethoxy-5-hydroxy-2-[(E)-oct-1-enyl]cyclopentyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[3-ethoxy-5-hydroxy-2-[(E)-oct-1-enyl]cyclopentyl]hept-5-enoate Traditional Name: (E)-7-[3-ethoxy-5-hydroxy-2-[(E)-oct-1-enyl]cyclopentyl]hept-5-enoic acid methyl ester Formula: C23H40O4 MolecularWeight: 380.5613

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1C(CC(C1CC=CCCCC(=O)OC)O)OCC

Isomeric SMILES

CCCCCC/C=C/C1C(CC(C1C/C=C/CCCC(=O)OC)O)OCC

InChI

InChI=1S/C23H40O4/c1-4-6-7-8-9-13-16-20-19(21(24)18-22(20)27-5-2)15-12-10-11-14-17-23(25)26-3/h10,12-13,16,19-22,24H,4-9,11,14-15,17-18H2,1-3H3/b12-10+,16-13+