(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(4-chloranylphenoxy)-2-methyl-propanoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-chlorophenoxy)-2-methyl-propionic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C22H26ClN3O5S MolecularWeight: 479.97694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN3O5S/c1-4-5-12-26-19-11-10-17(32(24,28)29)13-18(19)25-20(26)14-30-21(27)22(2,3)31-16-8-6-15(23)7-9-16/h6-11,13H,4-5,12,14H2,1-3H3,(H2,24,28,29)