4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]benzoic acid

Systemtic Name: 4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]benzoic acid Openeye Name: 4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]benzoic acid CAS Name: 4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]benzoic acid IUPAC Name: 4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]benzoic acid Traditional Name: 4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]benzoic acid Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24O6/c1-3-5-18-19(11-10-17(14(2)22)20(18)23)27-13-4-12-26-16-8-6-15(7-9-16)21(24)25/h6-11,23H,3-5,12-13H2,1-2H3,(H,24,25)