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

Systemtic Name: 3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]benzoic acid Openeye Name: 3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]benzoic acid CAS Name: 3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]benzoic acid IUPAC Name: 3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]benzoic acid Traditional Name: 3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]benzoic acid Formula: C19H20O5 MolecularWeight: 328.3591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O5/c1-3-5-16-17(9-8-15(12(2)20)18(16)21)24-11-13-6-4-7-14(10-13)19(22)23/h4,6-10,21H,3,5,11H2,1-2H3,(H,22,23)