6-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-methyl-hexanoic acid

Systemtic Name: 6-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-methyl-hexanoic acid Openeye Name: 6-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-methyl-hexanoic acid CAS Name: 6-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-methylhexanoic acid IUPAC Name: 6-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-methylhexanoic acid Traditional Name: 6-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-methyl-hexanoic acid Formula: C18H26O5 MolecularWeight: 322.39604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26O5/c1-4-7-15-16(10-9-14(13(3)19)17(15)20)23-11-6-5-8-12(2)18(21)22/h9-10,12,20H,4-8,11H2,1-3H3,(H,21,22)