N-(4-bromanyl-2-ethyl-phenyl)-2-nitro-benzenesulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H13BrN2O4S/c1-2-10-9-11(15)7-8-12(10)16-22(20,21)14-6-4-3-5-13(14)17(18)19/h3-9,16H,2H2,1H3