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

Systemtic Name: N-(4-azanyl-3-nitro-phenyl)-4-bromanyl-3-methyl-benzenesulfonamide Openeye Name: N-(4-amino-3-nitro-phenyl)-4-bromo-3-methyl-benzenesulfonamide CAS Name: N-(4-amino-3-nitrophenyl)-4-bromo-3-methylbenzenesulfonamide IUPAC Name: N-(4-amino-3-nitrophenyl)-4-bromo-3-methylbenzenesulfonamide Traditional Name: N-(4-amino-3-nitro-phenyl)-4-bromo-3-methyl-benzenesulfonamide Formula: C13H12BrN3O4S MolecularWeight: 386.22108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrN3O4S/c1-8-6-10(3-4-11(8)14)22(20,21)16-9-2-5-12(15)13(7-9)17(18)19/h2-7,16H,15H2,1H3