methyl (7E)-7-[(2R,3R)-3-oxidanyl-5-oxidanylidene-2-[(3S)-3-oxidanyloctyl]cyclopentylidene]heptanoate

Systemtic Name: methyl (7E)-7-[(2R,3R)-3-oxidanyl-5-oxidanylidene-2-[(3S)-3-oxidanyloctyl]cyclopentylidene]heptanoate Openeye Name: methyl (7E)-7-[(2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxo-cyclopentylidene]heptanoate CAS Name: (7E)-7-[(2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxocyclopentylidene]heptanoic acid methyl ester IUPAC Name: methyl (7E)-7-[(2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxocyclopentylidene]heptanoate Traditional Name: (7E)-7-[(2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoctyl]-5-keto-cyclopentylidene]enanthic acid methyl ester Formula: C21H36O5 MolecularWeight: 368.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1C(CC(=O)C1=CCCCCCC(=O)OC)O)O

Isomeric SMILES

CCCCC[C@@H](CC[C@H]\1[C@@H](CC(=O)/C1=C/CCCCCC(=O)OC)O)O

InChI

InChI=1S/C21H36O5/c1-3-4-7-10-16(22)13-14-18-17(19(23)15-20(18)24)11-8-5-6-9-12-21(25)26-2/h11,16,18,20,22,24H,3-10,12-15H2,1-2H3/b17-11+/t16-,18+,20+/m0/s1