methyl 7-[5-chloranyl-2-[(E)-4-methyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-cyclopentyl]hepta-4,5-dienoate

Systemtic Name: methyl 7-[5-chloranyl-2-[(E)-4-methyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-cyclopentyl]hepta-4,5-dienoate Openeye Name: methyl 7-[5-chloro-3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-enyl]cyclopentyl]hepta-4,5-dienoate CAS Name: 7-[5-chloro-3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-enyl]cyclopentyl]hepta-4,5-dienoic acid methyl ester IUPAC Name: methyl 7-[5-chloro-3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-enyl]cyclopentyl]hepta-4,5-dienoate Traditional Name: 7-[5-chloro-3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-enyl]cyclopentyl]hepta-4,5-dienoic acid methyl ester Formula: C22H35ClO4 MolecularWeight: 398.9639

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C=CC1C(CC(C1CC=C=CCCC(=O)OC)Cl)O)O

Isomeric SMILES

CCCCC(C)C(/C=C/C1C(CC(C1CC=C=CCCC(=O)OC)Cl)O)O

InChI

InChI=1S/C22H35ClO4/c1-4-5-10-16(2)20(24)14-13-18-17(19(23)15-21(18)25)11-8-6-7-9-12-22(26)27-3/h7-8,13-14,16-21,24-25H,4-5,9-12,15H2,1-3H3/b14-13+