2-[2-(4-methyl-3-oxidanyl-octyl)-5-oxidanyl-3-(4-phenylphenyl)carbonyloxy-cyclopentyl]ethanoic acid

Systemtic Name: 2-[2-(4-methyl-3-oxidanyl-octyl)-5-oxidanyl-3-(4-phenylphenyl)carbonyloxy-cyclopentyl]ethanoic acid Openeye Name: 2-[5-hydroxy-2-(3-hydroxy-4-methyl-octyl)-3-(4-phenylbenzoyl)oxy-cyclopentyl]acetic acid CAS Name: 2-[5-hydroxy-2-(3-hydroxy-4-methyloctyl)-3-[oxo-(4-phenylphenyl)methoxy]cyclopentyl]acetic acid IUPAC Name: 2-[5-hydroxy-2-(3-hydroxy-4-methyloctyl)-3-(4-phenylbenzoyl)oxycyclopentyl]acetic acid Traditional Name: 2-[5-hydroxy-2-(3-hydroxy-4-methyl-octyl)-3-(4-phenylbenzoyl)oxy-cyclopentyl]acetic acid Formula: C29H38O6 MolecularWeight: 482.60842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(CCC1C(CC(C1CC(=O)O)O)OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)O

Isomeric SMILES

CCCCC(C)C(CCC1C(CC(C1CC(=O)O)O)OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C29H38O6/c1-3-4-8-19(2)25(30)16-15-23-24(17-28(32)33)26(31)18-27(23)35-29(34)22-13-11-21(12-14-22)20-9-6-5-7-10-20/h5-7,9-14,19,23-27,30-31H,3-4,8,15-18H2,1-2H3,(H,32,33)