5-chloranyl-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]thiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-N-[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]thiophene-2-sulfonamide Openeye Name: 5-chloro-N-[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]thiophene-2-sulfonamide CAS Name: 5-chloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-2-thiophenesulfonamide IUPAC Name: 5-chloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]thiophene-2-sulfonamide Traditional Name: 5-chloro-N-[2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]thiophene-2-sulfonamide Formula: C13H13ClN2O6S2 MolecularWeight: 392.83512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(CO)NS(=O)(=O)C2=CC=C(S2)Cl)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(C(CO)NS(=O)(=O)C2=CC=C(S2)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C13H13ClN2O6S2/c14-11-5-6-12(23-11)24(21,22)15-10(7-17)13(18)8-1-3-9(4-2-8)16(19)20/h1-6,10,13,15,17-18H,7H2