methyl 2-(butylamino)-5-(dimethylsulfamoyl)-3-phenoxy-benzoate

Systemtic Name: methyl 2-(butylamino)-5-(dimethylsulfamoyl)-3-phenoxy-benzoate Openeye Name: methyl 2-(butylamino)-5-(dimethylsulfamoyl)-3-phenoxy-benzoate CAS Name: 2-(butylamino)-5-(dimethylsulfamoyl)-3-phenoxybenzoic acid methyl ester IUPAC Name: methyl 2-(butylamino)-5-(dimethylsulfamoyl)-3-phenoxybenzoate Traditional Name: 2-(butylamino)-5-(dimethylsulfamoyl)-3-phenoxy-benzoic acid methyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1C(=O)OC)S(=O)(=O)N(C)C)OC2=CC=CC=C2

Isomeric SMILES

CCCCNC1=C(C=C(C=C1C(=O)OC)S(=O)(=O)N(C)C)OC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O5S/c1-5-6-12-21-19-17(20(23)26-4)13-16(28(24,25)22(2)3)14-18(19)27-15-10-8-7-9-11-15/h7-11,13-14,21H,5-6,12H2,1-4H3