(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 5-methyl-2-oxidanyl-benzoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 5-methyl-2-oxidanyl-benzoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-hydroxy-5-methyl-benzoate CAS Name: 2-hydroxy-5-methylbenzoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 2-hydroxy-5-methylbenzoate Traditional Name: 2-hydroxy-5-methyl-benzoic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O5S/c1-3-4-9-23-17-7-6-14(29(21,26)27)11-16(17)22-19(23)12-28-20(25)15-10-13(2)5-8-18(15)24/h5-8,10-11,24H,3-4,9,12H2,1-2H3,(H2,21,26,27)