5-(3-methoxy-3-oxidanylidene-propyl)sulfanylpentanoic acid

Systemtic Name: 5-(3-methoxy-3-oxidanylidene-propyl)sulfanylpentanoic acid Openeye Name: 5-(3-methoxy-3-oxo-propyl)sulfanylpentanoic acid CAS Name: 5-[(3-methoxy-3-oxopropyl)thio]pentanoic acid IUPAC Name: 5-(3-methoxy-3-oxopropyl)sulfanylpentanoic acid Traditional Name: 5-[(3-keto-3-methoxy-propyl)thio]valeric acid Formula: C9H16O4S MolecularWeight: 220.28594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCCCCC(=O)O

Isomeric SMILES

COC(=O)CCSCCCCC(=O)O

InChI

InChI=1S/C9H16O4S/c1-13-9(12)5-7-14-6-3-2-4-8(10)11/h2-7H2,1H3,(H,10,11)