propyl 3-chloranylsulfonyloxy-4-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: propyl 3-chloranylsulfonyloxy-4-methylsulfanyl-thiophene-2-carboxylate Openeye Name: propyl 3-chlorosulfonyloxy-4-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-chlorosulfonyloxy-4-(methylthio)-2-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 3-chlorosulfonyloxy-4-methylsulfanylthiophene-2-carboxylate Traditional Name: 3-chlorosulfonyloxy-4-(methylthio)thiophene-2-carboxylic acid propyl ester Formula: C9H11ClO5S3 MolecularWeight: 330.82864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C(=CS1)SC)OS(=O)(=O)Cl

Isomeric SMILES

CCCOC(=O)C1=C(C(=CS1)SC)OS(=O)(=O)Cl

InChI

InChI=1S/C9H11ClO5S3/c1-3-4-14-9(11)8-7(15-18(10,12)13)6(16-2)5-17-8/h5H,3-4H2,1-2H3