N-(4-iodanyl-2-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(4-iodo-2-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(4-iodo-2-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C14H13IN2O4S MolecularWeight: 432.23349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)I)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)I)C)[N+](=O)[O-]

InChI

InChI=1S/C14H13IN2O4S/c1-9-3-5-12(8-14(9)17(18)19)22(20,21)16-13-6-4-11(15)7-10(13)2/h3-8,16H,1-2H3