methyl 2-ethyl-4-(4-methylphenyl)-5-sulfamoyl-benzoate

Systemtic Name: methyl 2-ethyl-4-(4-methylphenyl)-5-sulfamoyl-benzoate Openeye Name: methyl 2-ethyl-4-(p-tolyl)-5-sulfamoyl-benzoate CAS Name: 2-ethyl-4-(4-methylphenyl)-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 2-ethyl-4-(4-methylphenyl)-5-sulfamoylbenzoate Traditional Name: 2-ethyl-4-(p-tolyl)-5-sulfamoyl-benzoic acid methyl ester Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)N)C(=O)OC

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)N)C(=O)OC

InChI

InChI=1S/C17H19NO4S/c1-4-12-9-14(13-7-5-11(2)6-8-13)16(23(18,20)21)10-15(12)17(19)22-3/h5-10H,4H2,1-3H3,(H2,18,20,21)