3-nitro-4-oxidanyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-nitro-4-oxidanyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: 4-hydroxy-3-nitro-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-benzyl-4-hydroxy-3-nitro-benzenesulfonamide Formula: C13H12N2O5S MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O5S/c16-13-7-6-11(8-12(13)15(17)18)21(19,20)14-9-10-4-2-1-3-5-10/h1-8,14,16H,9H2