ethyl 6-[(1R,5R)-5-hexyl-2-oct-1-ynyl-4-oxidanylidene-cyclopent-2-en-1-yl]oxyhexanoate

Systemtic Name: ethyl 6-[(1R,5R)-5-hexyl-2-oct-1-ynyl-4-oxidanylidene-cyclopent-2-en-1-yl]oxyhexanoate Openeye Name: ethyl 6-[(1R,5R)-5-hexyl-2-oct-1-ynyl-4-oxo-cyclopent-2-en-1-yl]oxyhexanoate CAS Name: 6-[[(1R,5R)-5-hexyl-2-oct-1-ynyl-4-oxo-1-cyclopent-2-enyl]oxy]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[(1R,5R)-5-hexyl-2-oct-1-ynyl-4-oxocyclopent-2-en-1-yl]oxyhexanoate Traditional Name: 6-[(1R,5R)-5-hexyl-4-keto-2-oct-1-ynyl-cyclopent-2-en-1-yl]oxyhexanoic acid ethyl ester Formula: C27H44O4 MolecularWeight: 432.63586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC(=O)C(C1OCCCCCC(=O)OCC)CCCCCC

Isomeric SMILES

CCCCCCC#CC1=CC(=O)[C@@H]([C@H]1OCCCCCC(=O)OCC)CCCCCC

InChI

InChI=1S/C27H44O4/c1-4-7-9-11-12-14-18-23-22-25(28)24(19-15-10-8-5-2)27(23)31-21-17-13-16-20-26(29)30-6-3/h22,24,27H,4-13,15-17,19-21H2,1-3H3/t24-,27-/m0/s1