N-[[4-[2-(hydroxymethyl)-3-oxidanyl-propyl]phenyl]methyl]-2-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide

Systemtic Name: N-[[4-[2-(hydroxymethyl)-3-oxidanyl-propyl]phenyl]methyl]-2-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide Openeye Name: N-[[4-[3-hydroxy-2-(hydroxymethyl)propyl]phenyl]methyl]-2-nitro-N-(2-pyridylmethyl)benzenesulfonamide CAS Name: N-[[4-[3-hydroxy-2-(hydroxymethyl)propyl]phenyl]methyl]-2-nitro-N-(2-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-[[4-[3-hydroxy-2-(hydroxymethyl)propyl]phenyl]methyl]-2-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide Traditional Name: N-[4-(3-hydroxy-2-methylol-propyl)benzyl]-2-nitro-N-(2-pyridylmethyl)benzenesulfonamide Formula: C23H25N3O6S MolecularWeight: 471.5261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)CC(CO)CO)CC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)CC(CO)CO)CC3=CC=CC=N3

InChI

InChI=1S/C23H25N3O6S/c27-16-20(17-28)13-18-8-10-19(11-9-18)14-25(15-21-5-3-4-12-24-21)33(31,32)23-7-2-1-6-22(23)26(29)30/h1-12,20,27-28H,13-17H2