4-chloranyl-N-(3-iodanyl-4-methyl-phenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(3-iodanyl-4-methyl-phenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(3-iodo-4-methyl-phenyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(3-iodo-4-methylphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(3-iodo-4-methylphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(3-iodo-4-methyl-phenyl)-3-nitro-benzenesulfonamide Formula: C13H10ClIN2O4S MolecularWeight: 452.65197

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClIN2O4S/c1-8-2-3-9(6-12(8)15)16-22(20,21)10-4-5-11(14)13(7-10)17(18)19/h2-7,16H,1H3