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

Systemtic Name: methyl 4-(4-methylphenyl)-2-propyl-5-sulfamoyl-benzoate Openeye Name: methyl 2-propyl-4-(p-tolyl)-5-sulfamoyl-benzoate CAS Name: 4-(4-methylphenyl)-2-propyl-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-2-propyl-5-sulfamoylbenzoate Traditional Name: 2-propyl-4-(p-tolyl)-5-sulfamoyl-benzoic acid methyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)N)C(=O)OC

Isomeric SMILES

CCCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)N)C(=O)OC

InChI

InChI=1S/C18H21NO4S/c1-4-5-14-10-15(13-8-6-12(2)7-9-13)17(24(19,21)22)11-16(14)18(20)23-3/h6-11H,4-5H2,1-3H3,(H2,19,21,22)