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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(2-bromo-4-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(2-bromo-4-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C14H13BrN2O4S MolecularWeight: 385.23302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O4S/c1-9-3-6-13(12(15)7-9)16-22(20,21)11-5-4-10(2)14(8-11)17(18)19/h3-8,16H,1-2H3