4-[3-[5-(6-chloranyl-4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-4-ethanoyl-2-propyl-phenoxy]butanoic acid

Systemtic Name: 4-[3-[5-(6-chloranyl-4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-4-ethanoyl-2-propyl-phenoxy]butanoic acid Openeye Name: 4-[4-acetyl-3-[5-(4-acetyl-6-chloro-3-hydroxy-2-propyl-phenoxy)pentoxy]-2-propyl-phenoxy]butanoic acid CAS Name: 4-[4-acetyl-3-[5-(4-acetyl-6-chloro-3-hydroxy-2-propylphenoxy)pentoxy]-2-propylphenoxy]butanoic acid IUPAC Name: 4-[4-acetyl-3-[5-(4-acetyl-6-chloro-3-hydroxy-2-propylphenoxy)pentoxy]-2-propylphenoxy]butanoic acid Traditional Name: 4-[4-acetyl-3-[5-(4-acetyl-6-chloro-3-hydroxy-2-propyl-phenoxy)pentoxy]-2-propyl-phenoxy]butyric acid Formula: C31H41ClO8 MolecularWeight: 577.10544

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OCCCCCOC2=C(C=C(C(=C2CCC)O)C(=O)C)Cl)C(=O)C)OCCCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1OCCCCCOC2=C(C=C(C(=C2CCC)O)C(=O)C)Cl)C(=O)C)OCCCC(=O)O

InChI

InChI=1S/C31H41ClO8/c1-5-11-23-27(38-18-10-13-28(35)36)15-14-22(20(3)33)30(23)39-16-8-7-9-17-40-31-24(12-6-2)29(37)25(21(4)34)19-26(31)32/h14-15,19,37H,5-13,16-18H2,1-4H3,(H,35,36)