5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-(sulfanylmethyl)pentanoic acid

Systemtic Name: 5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-(sulfanylmethyl)pentanoic acid Openeye Name: 5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-(sulfanylmethyl)pentanoic acid CAS Name: 5-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-(mercaptomethyl)pentanoic acid IUPAC Name: 5-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-(sulfanylmethyl)pentanoic acid Traditional Name: 5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-(mercaptomethyl)valeric acid Formula: C17H24O5S MolecularWeight: 340.43446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCC(CS)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCC(CS)C(=O)O

InChI

InChI=1S/C17H24O5S/c1-3-5-14-15(8-7-13(11(2)18)16(14)19)22-9-4-6-12(10-23)17(20)21/h7-8,12,19,23H,3-6,9-10H2,1-2H3,(H,20,21)