N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-hydroxy-3-nitro-benzenesulfonamide Formula: C14H13ClN2O7S MolecularWeight: 388.78022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C14H13ClN2O7S/c1-23-13-7-14(24-2)10(6-9(13)15)16-25(21,22)8-3-4-12(18)11(5-8)17(19)20/h3-7,16,18H,1-2H3