2-[3-[(4-ethanoyl-3-methyl-phenoxy)methyl]-5-[(4-methanoyl-3-methyl-phenoxy)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[(4-ethanoyl-3-methyl-phenoxy)methyl]-5-[(4-methanoyl-3-methyl-phenoxy)methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[(4-acetyl-3-methyl-phenoxy)methyl]-5-[(4-formyl-3-methyl-phenoxy)methyl]phenoxy]acetic acid CAS Name: 2-[3-[(4-acetyl-3-methylphenoxy)methyl]-5-[(4-formyl-3-methylphenoxy)methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[(4-acetyl-3-methylphenoxy)methyl]-5-[(4-formyl-3-methylphenoxy)methyl]phenoxy]acetic acid Traditional Name: 2-[3-[(4-acetyl-3-methyl-phenoxy)methyl]-5-[(4-formyl-3-methyl-phenoxy)methyl]phenoxy]acetic acid Formula: C27H26O7 MolecularWeight: 462.49114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC(=CC(=C2)OCC(=O)O)COC3=CC(=C(C=C3)C(=O)C)C)C=O

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC(=CC(=C2)OCC(=O)O)COC3=CC(=C(C=C3)C(=O)C)C)C=O

InChI

InChI=1S/C27H26O7/c1-17-8-23(5-4-22(17)13-28)32-14-20-10-21(12-25(11-20)34-16-27(30)31)15-33-24-6-7-26(19(3)29)18(2)9-24/h4-13H,14-16H2,1-3H3,(H,30,31)