methyl (E)-7-[2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-phenoxy-cyclopentyl]hept-4-enoate

Systemtic Name: methyl (E)-7-[2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-phenoxy-cyclopentyl]hept-4-enoate Openeye Name: methyl (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-phenoxy-cyclopentyl]hept-4-enoate CAS Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-phenoxycyclopentyl]-4-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-phenoxycyclopentyl]hept-4-enoate Traditional Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-phenoxy-cyclopentyl]hept-4-enoic acid methyl ester Formula: C29H44O5 MolecularWeight: 472.65666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(C=CC1C(CC(C1CCC=CCCC(=O)OC)OC2=CC=CC=C2)O)O

Isomeric SMILES

CCCCC(C)(C)C(/C=C/C1C(CC(C1CC/C=C/CCC(=O)OC)OC2=CC=CC=C2)O)O

InChI

InChI=1S/C29H44O5/c1-5-6-20-29(2,3)27(31)19-18-23-24(16-12-7-8-13-17-28(32)33-4)26(21-25(23)30)34-22-14-10-9-11-15-22/h7-11,14-15,18-19,23-27,30-31H,5-6,12-13,16-17,20-21H2,1-4H3/b8-7+,19-18+