1-oxidanidyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 1-oxidanidyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)pyridin-1-ium-3-carboxamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-1-oxido-pyridin-1-ium-3-carboxamide Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C16H17N3O5S/c20-15-6-5-13(25(23,24)19-8-1-2-9-19)10-14(15)17-16(21)12-4-3-7-18(22)11-12/h3-7,10-11,20H,1-2,8-9H2,(H,17,21)