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

Systemtic Name: 4-chloranyl-N-(3,5-dimethoxyphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(3,5-dimethoxyphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(3,5-dimethoxyphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(3,5-dimethoxyphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(3,5-dimethoxyphenyl)-3-nitro-benzenesulfonamide Formula: C14H13ClN2O6S MolecularWeight: 372.78082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN2O6S/c1-22-10-5-9(6-11(7-10)23-2)16-24(20,21)12-3-4-13(15)14(8-12)17(18)19/h3-8,16H,1-2H3