2-(4-phenylphenoxy)-5-sulfanyl-pentanoic acid

Systemtic Name: 2-(4-phenylphenoxy)-5-sulfanyl-pentanoic acid Openeye Name: 2-(4-phenylphenoxy)-5-sulfanyl-pentanoic acid CAS Name: 5-mercapto-2-(4-phenylphenoxy)pentanoic acid IUPAC Name: 2-(4-phenylphenoxy)-5-sulfanylpentanoic acid Traditional Name: 5-mercapto-2-(4-phenylphenoxy)valeric acid Formula: C17H18O3S MolecularWeight: 302.38802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OC(CCCS)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OC(CCCS)C(=O)O

InChI

InChI=1S/C17H18O3S/c18-17(19)16(7-4-12-21)20-15-10-8-14(9-11-15)13-5-2-1-3-6-13/h1-3,5-6,8-11,16,21H,4,7,12H2,(H,18,19)