N-(2-bromanyl-4-methyl-phenyl)-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-methoxy-5-nitro-benzenesulfonamide CAS Name: N-(2-bromo-4-methylphenyl)-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-methoxy-5-nitro-benzenesulfonamide Formula: C14H13BrN2O5S MolecularWeight: 401.23242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O5S/c1-9-3-5-12(11(15)7-9)16-23(20,21)14-8-10(17(18)19)4-6-13(14)22-2/h3-8,16H,1-2H3