1-[4-[4-(2-methyl-3H-benzimidazol-5-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]phenyl]sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-[4-(2-methyl-3H-benzimidazol-5-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]phenyl]sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[1-carboxy-3-(2-methyl-3H-benzimidazol-5-yl)propyl]phenyl]sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[4-[1-hydroxy-4-(2-methyl-3H-benzimidazol-5-yl)-1-oxobutan-2-yl]phenyl]sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[1-hydroxy-4-(2-methyl-3H-benzimidazol-5-yl)-1-oxobutan-2-yl]phenyl]sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[1-carboxy-3-(2-methyl-3H-benzimidazol-5-yl)propyl]phenyl]sulfonylproline Formula: C23H25N3O6S MolecularWeight: 471.5261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1)C=C(C=C2)CCC(C3=CC=C(C=C3)S(=O)(=O)N4CCCC4C(=O)O)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1)C=C(C=C2)CCC(C3=CC=C(C=C3)S(=O)(=O)N4CCCC4C(=O)O)C(=O)O

InChI

InChI=1S/C23H25N3O6S/c1-14-24-19-11-5-15(13-20(19)25-14)4-10-18(22(27)28)16-6-8-17(9-7-16)33(31,32)26-12-2-3-21(26)23(29)30/h5-9,11,13,18,21H,2-4,10,12H2,1H3,(H,24,25)(H,27,28)(H,29,30)