7-[3-acetyloxy-2-[1,2-bis(oxidanyl)-2-phenyl-ethyl]-5-oxidanylidene-cyclopenten-1-yl]heptanoate

Systemtic Name: 7-[3-acetyloxy-2-[1,2-bis(oxidanyl)-2-phenyl-ethyl]-5-oxidanylidene-cyclopenten-1-yl]heptanoate Openeye Name: 7-[3-acetoxy-2-(1,2-dihydroxy-2-phenyl-ethyl)-5-oxo-cyclopenten-1-yl]heptanoate CAS Name: 7-[3-acetyloxy-2-(1,2-dihydroxy-2-phenylethyl)-5-oxo-1-cyclopentenyl]heptanoate IUPAC Name: 7-[3-acetyloxy-2-(1,2-dihydroxy-2-phenylethyl)-5-oxocyclopenten-1-yl]heptanoate Traditional Name: 7-[3-acetoxy-2-(1,2-dihydroxy-2-phenyl-ethyl)-5-keto-cyclopenten-1-yl]enanthate Formula: C22H27O7- MolecularWeight: 403.44558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=O)C(=C1C(C(C2=CC=CC=C2)O)O)CCCCCCC(=O)[O-]

Isomeric SMILES

CC(=O)OC1CC(=O)C(=C1C(C(C2=CC=CC=C2)O)O)CCCCCCC(=O)[O-]

InChI

InChI=1S/C22H28O7/c1-14(23)29-18-13-17(24)16(11-7-2-3-8-12-19(25)26)20(18)22(28)21(27)15-9-5-4-6-10-15/h4-6,9-10,18,21-22,27-28H,2-3,7-8,11-13H2,1H3,(H,25,26)/p-1