N-(4-azanyl-3-nitro-phenyl)-5-bromanyl-2-methyl-benzenesulfonamide

Systemtic Name: N-(4-azanyl-3-nitro-phenyl)-5-bromanyl-2-methyl-benzenesulfonamide Openeye Name: N-(4-amino-3-nitro-phenyl)-5-bromo-2-methyl-benzenesulfonamide CAS Name: N-(4-amino-3-nitrophenyl)-5-bromo-2-methylbenzenesulfonamide IUPAC Name: N-(4-amino-3-nitrophenyl)-5-bromo-2-methylbenzenesulfonamide Traditional Name: N-(4-amino-3-nitro-phenyl)-5-bromo-2-methyl-benzenesulfonamide Formula: C13H12BrN3O4S MolecularWeight: 386.22108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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