5-chloranyl-N-(3,4-dimethylphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: 5-chloranyl-N-(3,4-dimethylphenyl)-2-nitro-benzenesulfonamide Openeye Name: 5-chloro-N-(3,4-dimethylphenyl)-2-nitro-benzenesulfonamide CAS Name: 5-chloro-N-(3,4-dimethylphenyl)-2-nitrobenzenesulfonamide IUPAC Name: 5-chloro-N-(3,4-dimethylphenyl)-2-nitrobenzenesulfonamide Traditional Name: 5-chloro-N-(3,4-dimethylphenyl)-2-nitro-benzenesulfonamide Formula: C14H13ClN2O4S MolecularWeight: 340.78202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H13ClN2O4S/c1-9-3-5-12(7-10(9)2)16-22(20,21)14-8-11(15)4-6-13(14)17(18)19/h3-8,16H,1-2H3