4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-3-propyl-phenyl]-3-methyl-4-oxidanyl-butanoic acid

Systemtic Name: 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-3-propyl-phenyl]-3-methyl-4-oxidanyl-butanoic acid Openeye Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-3-propyl-phenyl]-4-hydroxy-3-methyl-butanoic acid CAS Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-3-propylphenyl]-4-hydroxy-3-methylbutanoic acid IUPAC Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-3-propylphenyl]-4-hydroxy-3-methylbutanoic acid Traditional Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-3-propyl-phenyl]-4-hydroxy-3-methyl-butyric acid Formula: C28H38O7 MolecularWeight: 486.59712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(C(C)CC(=O)O)O)OCCCOC2=C(C(=C(C=C2)C(=O)C)O)CCC

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(C(C)CC(=O)O)O)OCCCOC2=C(C(=C(C=C2)C(=O)C)O)CCC

InChI

InChI=1S/C28H38O7/c1-5-8-20-17-21(27(32)18(3)16-26(30)31)10-12-24(20)34-14-7-15-35-25-13-11-22(19(4)29)28(33)23(25)9-6-2/h10-13,17-18,27,32-33H,5-9,14-16H2,1-4H3,(H,30,31)