5-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]-1H-imidazole-4-carboxylic acid

Systemtic Name: 5-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]-1H-imidazole-4-carboxylic acid Openeye Name: 5-(1-benzylsulfonylpyrrolidin-2-yl)-1H-imidazole-4-carboxylic acid CAS Name: 5-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]-1H-imidazole-4-carboxylic acid IUPAC Name: 5-(1-benzylsulfonylpyrrolidin-2-yl)-1H-imidazole-4-carboxylic acid Traditional Name: 5-(1-benzylsulfonylpyrrolidin-2-yl)-1H-imidazole-4-carboxylic acid Formula: C15H17N3O4S MolecularWeight: 335.37818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3=C(N=CN3)C(=O)O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3=C(N=CN3)C(=O)O

InChI

InChI=1S/C15H17N3O4S/c19-15(20)14-13(16-10-17-14)12-7-4-8-18(12)23(21,22)9-11-5-2-1-3-6-11/h1-3,5-6,10,12H,4,7-9H2,(H,16,17)(H,19,20)