2-[3-chloranyl-4-[3-(3-oxidanyl-4-propanoyl-2-propyl-phenoxy)propoxy]phenyl]propanoic acid

Systemtic Name: 2-[3-chloranyl-4-[3-(3-oxidanyl-4-propanoyl-2-propyl-phenoxy)propoxy]phenyl]propanoic acid Openeye Name: 2-[3-chloro-4-[3-(3-hydroxy-4-propanoyl-2-propyl-phenoxy)propoxy]phenyl]propanoic acid CAS Name: 2-[3-chloro-4-[3-[3-hydroxy-4-(1-oxopropyl)-2-propylphenoxy]propoxy]phenyl]propanoic acid IUPAC Name: 2-[3-chloro-4-[3-(3-hydroxy-4-propanoyl-2-propylphenoxy)propoxy]phenyl]propanoic acid Traditional Name: 2-[3-chloro-4-[3-(3-hydroxy-4-propionyl-2-propyl-phenoxy)propoxy]phenyl]propionic acid Formula: C24H29ClO6 MolecularWeight: 448.93646

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)CC)OCCCOC2=C(C=C(C=C2)C(C)C(=O)O)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)CC)OCCCOC2=C(C=C(C=C2)C(C)C(=O)O)Cl

InChI

InChI=1S/C24H29ClO6/c1-4-7-18-21(11-9-17(23(18)27)20(26)5-2)30-12-6-13-31-22-10-8-16(14-19(22)25)15(3)24(28)29/h8-11,14-15,27H,4-7,12-13H2,1-3H3,(H,28,29)