(4-methylsulfanylphenyl)methyl 2-methoxy-5-sulfamoyl-benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-methoxy-5-sulfamoyl-benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-methoxy-5-sulfamoyl-benzoate CAS Name: 2-methoxy-5-sulfamoylbenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-methoxy-5-sulfamoylbenzoate Traditional Name: 2-methoxy-5-sulfamoyl-benzoic acid [4-(methylthio)benzyl] ester Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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