4-[(4-ethanoyl-2-hexyl-3-oxidanyl-phenoxy)methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[(4-ethanoyl-2-hexyl-3-oxidanyl-phenoxy)methyl]-3-methoxy-benzoic acid Openeye Name: 4-[(4-acetyl-2-hexyl-3-hydroxy-phenoxy)methyl]-3-methoxy-benzoic acid CAS Name: 4-[(4-acetyl-2-hexyl-3-hydroxyphenoxy)methyl]-3-methoxybenzoic acid IUPAC Name: 4-[(4-acetyl-2-hexyl-3-hydroxyphenoxy)methyl]-3-methoxybenzoic acid Traditional Name: 4-[(4-acetyl-2-hexyl-3-hydroxy-phenoxy)methyl]-3-methoxy-benzoic acid Formula: C23H28O6 MolecularWeight: 400.46482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C=C(C=C2)C(=O)O)OC

Isomeric SMILES

CCCCCCC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C23H28O6/c1-4-5-6-7-8-19-20(12-11-18(15(2)24)22(19)25)29-14-17-10-9-16(23(26)27)13-21(17)28-3/h9-13,25H,4-8,14H2,1-3H3,(H,26,27)