(4-methylsulfanylphenyl)methyl 4-methoxy-3-sulfamoyl-benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 4-methoxy-3-sulfamoyl-benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 4-methoxy-3-sulfamoyl-benzoate CAS Name: 4-methoxy-3-sulfamoylbenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 4-methoxy-3-sulfamoylbenzoate Traditional Name: 4-methoxy-3-sulfamoyl-benzoic acid [4-(methylthio)benzyl] ester Formula: C16H17NO5S2 MolecularWeight: 367.43988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)N

InChI

InChI=1S/C16H17NO5S2/c1-21-14-8-5-12(9-15(14)24(17,19)20)16(18)22-10-11-3-6-13(23-2)7-4-11/h3-9H,10H2,1-2H3,(H2,17,19,20)