4-(3-chloranyl-5-methoxy-phenyl)sulfanyl-3-oxidanylidene-butanoic acid

Systemtic Name: 4-(3-chloranyl-5-methoxy-phenyl)sulfanyl-3-oxidanylidene-butanoic acid Openeye Name: 4-(3-chloro-5-methoxy-phenyl)sulfanyl-3-oxo-butanoic acid CAS Name: 4-[(3-chloro-5-methoxyphenyl)thio]-3-oxobutanoic acid IUPAC Name: 4-(3-chloro-5-methoxyphenyl)sulfanyl-3-oxobutanoic acid Traditional Name: 4-[(3-chloro-5-methoxy-phenyl)thio]-3-keto-butyric acid Formula: C11H11ClO4S MolecularWeight: 274.72064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)Cl)SCC(=O)CC(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1)Cl)SCC(=O)CC(=O)O

InChI

InChI=1S/C11H11ClO4S/c1-16-9-2-7(12)3-10(5-9)17-6-8(13)4-11(14)15/h2-3,5H,4,6H2,1H3,(H,14,15)