(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3,5-dimethoxybenzoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3,5-dimethoxybenzoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O6S/c1-4-5-8-24-19-7-6-17(31(22,26)27)12-18(19)23-20(24)13-30-21(25)14-9-15(28-2)11-16(10-14)29-3/h6-7,9-12H,4-5,8,13H2,1-3H3,(H2,22,26,27)