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

Systemtic Name: methyl 7-[(1S,2R,3R)-2-hex-1-ynyl-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: methyl 7-[(1S,2R,3R)-2-hex-1-ynyl-3-hydroxy-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[(1S,2R,3R)-2-hex-1-ynyl-3-hydroxy-5-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[(1S,2R,3R)-2-hex-1-ynyl-3-hydroxy-5-oxocyclopentyl]heptanoate Traditional Name: 7-[(1S,2R,3R)-2-hex-1-ynyl-3-hydroxy-5-keto-cyclopentyl]enanthic acid methyl ester Formula: C19H30O4 MolecularWeight: 322.4391

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1C(CC(=O)C1CCCCCCC(=O)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C19H30O4/c1-3-4-5-8-11-15-16(18(21)14-17(15)20)12-9-6-7-10-13-19(22)23-2/h15-17,20H,3-7,9-10,12-14H2,1-2H3/t15-,16-,17+/m0/s1