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

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3-methyl-2-oxidanyl-benzoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-hydroxy-3-methyl-benzoate CAS Name: 2-hydroxy-3-methylbenzoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 2-hydroxy-3-methylbenzoate Traditional Name: 2-hydroxy-3-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/c1-3-4-10-23-17-9-8-14(29(21,26)27)11-16(17)22-18(23)12-28-20(25)15-7-5-6-13(2)19(15)24/h5-9,11,24H,3-4,10,12H2,1-2H3,(H2,21,26,27)