(E)-7-[5-(5-chloranylpyridin-2-yl)oxy-2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[5-(5-chloranylpyridin-2-yl)oxy-2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[5-[(5-chloro-2-pyridyl)oxy]-3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[5-[(5-chloro-2-pyridinyl)oxy]-3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[5-(5-chloropyridin-2-yl)oxy-3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[5-[(5-chloro-2-pyridyl)oxy]-3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]cyclopentyl]hept-5-enoic acid Formula: C27H40ClNO5 MolecularWeight: 494.0632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(C=CC1C(CC(C1CC=CCCCC(=O)O)OC2=NC=C(C=C2)Cl)O)O

Isomeric SMILES

CCCCC(C)(C)C(/C=C/C1C(CC(C1C/C=C/CCCC(=O)O)OC2=NC=C(C=C2)Cl)O)O

InChI

InChI=1S/C27H40ClNO5/c1-4-5-16-27(2,3)24(31)14-13-20-21(10-8-6-7-9-11-26(32)33)23(17-22(20)30)34-25-15-12-19(28)18-29-25/h6,8,12-15,18,20-24,30-31H,4-5,7,9-11,16-17H2,1-3H3,(H,32,33)/b8-6+,14-13+