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

Systemtic Name: 4-[[4-ethanoyl-2-(2-methylprop-2-enyl)-3-oxidanyl-phenoxy]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[4-acetyl-3-hydroxy-2-(2-methylallyl)phenoxy]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[4-acetyl-3-hydroxy-2-(2-methylprop-2-enyl)phenoxy]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[4-acetyl-3-hydroxy-2-(2-methylprop-2-enyl)phenoxy]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[4-acetyl-3-hydroxy-2-(2-methylallyl)phenoxy]methyl]-3-methoxy-benzoic acid Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C=C(C=C2)C(=O)O)OC

Isomeric SMILES

CC(=C)CC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C21H22O6/c1-12(2)9-17-18(8-7-16(13(3)22)20(17)23)27-11-15-6-5-14(21(24)25)10-19(15)26-4/h5-8,10,23H,1,9,11H2,2-4H3,(H,24,25)