methyl 7-[(1S,2S,3R)-3-acetyloxy-2-oct-1-ynyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: methyl 7-[(1S,2S,3R)-3-acetyloxy-2-oct-1-ynyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: methyl 7-[(1S,2S,3R)-3-acetoxy-2-oct-1-ynyl-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[(1S,2S,3R)-3-acetyloxy-2-oct-1-ynyl-5-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[(1S,2S,3R)-3-acetyloxy-2-oct-1-ynyl-5-oxocyclopentyl]heptanoate Traditional Name: 7-[(1S,2S,3R)-3-acetoxy-5-keto-2-oct-1-ynyl-cyclopentyl]enanthic acid methyl ester Formula: C23H36O5 MolecularWeight: 392.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1C(CC(=O)C1CCCCCCC(=O)OC)OC(=O)C

Isomeric SMILES

CCCCCCC#C[C@H]1[C@@H](CC(=O)[C@H]1CCCCCCC(=O)OC)OC(=O)C

InChI

InChI=1S/C23H36O5/c1-4-5-6-7-8-12-15-20-19(21(25)17-22(20)28-18(2)24)14-11-9-10-13-16-23(26)27-3/h19-20,22H,4-11,13-14,16-17H2,1-3H3/t19-,20+,22+/m0/s1