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

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3-cyclohexylpropanoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3-cyclohexylpropanoate CAS Name: 3-cyclohexylpropanoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 3-cyclohexylpropanoate Traditional Name: 3-cyclohexylpropionic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C21H31N3O4S MolecularWeight: 421.55354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CCC3CCCCC3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CCC3CCCCC3

InChI

InChI=1S/C21H31N3O4S/c1-2-3-13-24-19-11-10-17(29(22,26)27)14-18(19)23-20(24)15-28-21(25)12-9-16-7-5-4-6-8-16/h10-11,14,16H,2-9,12-13,15H2,1H3,(H2,22,26,27)