N-(3,5-dimethoxyphenyl)-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-(3,5-dimethoxyphenyl)-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-(3,5-dimethoxyphenyl)-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-(3,5-dimethoxyphenyl)-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-(3,5-dimethoxyphenyl)-4-hydroxy-3-nitro-benzenesulfonamide Formula: C14H14N2O7S MolecularWeight: 354.33516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])OC

InChI

InChI=1S/C14H14N2O7S/c1-22-10-5-9(6-11(7-10)23-2)15-24(20,21)12-3-4-14(17)13(8-12)16(18)19/h3-8,15,17H,1-2H3