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

Systemtic Name: methyl 2-butyl-4-(4-methylphenyl)-5-sulfamoyl-benzoate Openeye Name: methyl 2-butyl-4-(p-tolyl)-5-sulfamoyl-benzoate CAS Name: 2-butyl-4-(4-methylphenyl)-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 2-butyl-4-(4-methylphenyl)-5-sulfamoylbenzoate Traditional Name: 2-butyl-4-(p-tolyl)-5-sulfamoyl-benzoic acid methyl ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)N)C(=O)OC

Isomeric SMILES

CCCCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)N)C(=O)OC

InChI

InChI=1S/C19H23NO4S/c1-4-5-6-15-11-16(14-9-7-13(2)8-10-14)18(25(20,22)23)12-17(15)19(21)24-3/h7-12H,4-6H2,1-3H3,(H2,20,22,23)