5-(4-methoxyphenyl)sulfanylpentanoic acid

Systemtic Name: 5-(4-methoxyphenyl)sulfanylpentanoic acid Openeye Name: 5-(4-methoxyphenyl)sulfanylpentanoic acid CAS Name: 5-[(4-methoxyphenyl)thio]pentanoic acid IUPAC Name: 5-(4-methoxyphenyl)sulfanylpentanoic acid Traditional Name: 5-[(4-methoxyphenyl)thio]valeric acid Formula: C12H16O3S MolecularWeight: 240.31864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)SCCCCC(=O)O

InChI

InChI=1S/C12H16O3S/c1-15-10-5-7-11(8-6-10)16-9-3-2-4-12(13)14/h5-8H,2-4,9H2,1H3,(H,13,14)