4-(4-methylsulfanylphenyl)-4-oxidanyl-but-2-ynoic acid

Systemtic Name: 4-(4-methylsulfanylphenyl)-4-oxidanyl-but-2-ynoic acid Openeye Name: 4-hydroxy-4-(4-methylsulfanylphenyl)but-2-ynoic acid CAS Name: 4-hydroxy-4-[4-(methylthio)phenyl]-2-butynoic acid IUPAC Name: 4-hydroxy-4-(4-methylsulfanylphenyl)but-2-ynoic acid Traditional Name: 4-hydroxy-4-[4-(methylthio)phenyl]but-2-ynoic acid Formula: C11H10O3S MolecularWeight: 222.2603

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C#CC(=O)O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(C#CC(=O)O)O

InChI

InChI=1S/C11H10O3S/c1-15-9-4-2-8(3-5-9)10(12)6-7-11(13)14/h2-5,10,12H,1H3,(H,13,14)