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

Systemtic Name: 4-[[4-ethanoyl-3-oxidanyl-2-(4-oxidanylidenepentyl)phenoxy]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[4-acetyl-3-hydroxy-2-(4-oxopentyl)phenoxy]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[4-acetyl-3-hydroxy-2-(4-oxopentyl)phenoxy]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[4-acetyl-3-hydroxy-2-(4-oxopentyl)phenoxy]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[4-acetyl-3-hydroxy-2-(4-ketopentyl)phenoxy]methyl]-3-methoxy-benzoic acid Formula: C22H24O7 MolecularWeight: 400.42176

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C=C(C=C2)C(=O)O)OC

Isomeric SMILES

CC(=O)CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C22H24O7/c1-13(23)5-4-6-18-19(10-9-17(14(2)24)21(18)25)29-12-16-8-7-15(22(26)27)11-20(16)28-3/h7-11,25H,4-6,12H2,1-3H3,(H,26,27)