4-[(4-ethanoyl-3-hexoxy-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[(4-ethanoyl-3-hexoxy-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid Openeye Name: 4-[(4-acetyl-3-hexoxy-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid CAS Name: 4-[(4-acetyl-3-hexoxy-2-propylphenoxy)methyl]-3-methoxybenzoic acid IUPAC Name: 4-[(4-acetyl-3-hexoxy-2-propylphenoxy)methyl]-3-methoxybenzoic acid Traditional Name: 4-[(4-acetyl-3-hexoxy-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid Formula: C26H34O6 MolecularWeight: 442.54456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC(=C1CCC)OCC2=C(C=C(C=C2)C(=O)O)OC)C(=O)C

Isomeric SMILES

CCCCCCOC1=C(C=CC(=C1CCC)OCC2=C(C=C(C=C2)C(=O)O)OC)C(=O)C

InChI

InChI=1S/C26H34O6/c1-5-7-8-9-15-31-25-21(18(3)27)13-14-23(22(25)10-6-2)32-17-20-12-11-19(26(28)29)16-24(20)30-4/h11-14,16H,5-10,15,17H2,1-4H3,(H,28,29)