4-chloranyl-N1-(4-methylsulfonyl-2-nitro-phenyl)benzene-1,3-diamine

Systemtic Name: 4-chloranyl-N1-(4-methylsulfonyl-2-nitro-phenyl)benzene-1,3-diamine Openeye Name: 4-chloro-N1-(4-methylsulfonyl-2-nitro-phenyl)benzene-1,3-diamine CAS Name: 4-chloro-N1-(4-methylsulfonyl-2-nitrophenyl)benzene-1,3-diamine IUPAC Name: 4-chloro-1-N-(4-methylsulfonyl-2-nitrophenyl)benzene-1,3-diamine Traditional Name: (3-amino-4-chloro-phenyl)-(4-mesyl-2-nitro-phenyl)amine Formula: C13H12ClN3O4S MolecularWeight: 341.77008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=C(C=C2)Cl)N)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=C(C=C2)Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C13H12ClN3O4S/c1-22(20,21)9-3-5-12(13(7-9)17(18)19)16-8-2-4-10(14)11(15)6-8/h2-7,16H,15H2,1H3