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

Systemtic Name: methyl (E)-7-[2-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]hept-5-enoate Openeye Name: methyl (E)-7-[2-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoate CAS Name: (E)-7-[2-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]cyclopentyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[2-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoate Traditional Name: (E)-7-[2-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid methyl ester Formula: C21H36O4 MolecularWeight: 352.50814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(C1CC=CCCCC(=O)OC)O)O

Isomeric SMILES

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

InChI

InChI=1S/C21H36O4/c1-3-4-7-10-18(22)15-13-17-14-16-20(23)19(17)11-8-5-6-9-12-21(24)25-2/h5,8,13,15,17-20,22-23H,3-4,6-7,9-12,14,16H2,1-2H3/b8-5+,15-13+