methyl 2-(2-methylphenyl)-4-(4-phenylbutylsulfamoyl)benzoate

Systemtic Name: methyl 2-(2-methylphenyl)-4-(4-phenylbutylsulfamoyl)benzoate Openeye Name: methyl 2-(o-tolyl)-4-(4-phenylbutylsulfamoyl)benzoate CAS Name: 2-(2-methylphenyl)-4-(4-phenylbutylsulfamoyl)benzoic acid methyl ester IUPAC Name: methyl 2-(2-methylphenyl)-4-(4-phenylbutylsulfamoyl)benzoate Traditional Name: 2-(o-tolyl)-4-(4-phenylbutylsulfamoyl)benzoic acid methyl ester Formula: C25H27NO4S MolecularWeight: 437.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)S(=O)(=O)NCCCCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)S(=O)(=O)NCCCCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H27NO4S/c1-19-10-6-7-14-22(19)24-18-21(15-16-23(24)25(27)30-2)31(28,29)26-17-9-8-13-20-11-4-3-5-12-20/h3-7,10-12,14-16,18,26H,8-9,13,17H2,1-2H3