7-[2-butanoyloxy-4-oxidanyl-5-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]cyclopenten-1-yl]heptanoate

Systemtic Name: 7-[2-butanoyloxy-4-oxidanyl-5-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]cyclopenten-1-yl]heptanoate Openeye Name: 7-[2-butanoyloxy-4-hydroxy-5-[(E)-3-hydroxy-4-phenyl-but-1-enyl]cyclopenten-1-yl]heptanoate CAS Name: 7-[4-hydroxy-5-[(E)-3-hydroxy-4-phenylbut-1-enyl]-2-(1-oxobutoxy)-1-cyclopentenyl]heptanoate IUPAC Name: 7-[2-butanoyloxy-4-hydroxy-5-[(E)-3-hydroxy-4-phenylbut-1-enyl]cyclopenten-1-yl]heptanoate Traditional Name: 7-[2-butyryloxy-4-hydroxy-5-[(E)-3-hydroxy-4-phenyl-but-1-enyl]cyclopenten-1-yl]enanthate Formula: C26H35O6- MolecularWeight: 443.5525

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(C(C1)O)C=CC(CC2=CC=CC=C2)O)CCCCCCC(=O)[O-]

Isomeric SMILES

CCCC(=O)OC1=C(C(C(C1)O)/C=C/C(CC2=CC=CC=C2)O)CCCCCCC(=O)[O-]

InChI

InChI=1S/C26H36O6/c1-2-10-26(31)32-24-18-23(28)21(22(24)13-8-3-4-9-14-25(29)30)16-15-20(27)17-19-11-6-5-7-12-19/h5-7,11-12,15-16,20-21,23,27-28H,2-4,8-10,13-14,17-18H2,1H3,(H,29,30)/p-1/b16-15+