4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-3-methyl-butanoic acid

Systemtic Name: 4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-3-methyl-butanoic acid Openeye Name: 4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-3-methyl-butanoic acid CAS Name: 4-(4-acetyl-3-hydroxy-2-propylphenoxy)-3-methylbutanoic acid IUPAC Name: 4-(4-acetyl-3-hydroxy-2-propylphenoxy)-3-methylbutanoic acid Traditional Name: 4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-3-methyl-butyric acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(C)CC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(C)CC(=O)O

InChI

InChI=1S/C16H22O5/c1-4-5-13-14(21-9-10(2)8-15(18)19)7-6-12(11(3)17)16(13)20/h6-7,10,20H,4-5,8-9H2,1-3H3,(H,18,19)