N2-(4-methylsulfonyl-2-nitro-phenyl)benzene-1,2-diamine

Systemtic Name: N2-(4-methylsulfonyl-2-nitro-phenyl)benzene-1,2-diamine Openeye Name: N2-(4-methylsulfonyl-2-nitro-phenyl)benzene-1,2-diamine CAS Name: N2-(4-methylsulfonyl-2-nitrophenyl)benzene-1,2-diamine IUPAC Name: 2-N-(4-methylsulfonyl-2-nitrophenyl)benzene-1,2-diamine Traditional Name: (2-aminophenyl)-(4-mesyl-2-nitro-phenyl)amine Formula: C13H13N3O4S MolecularWeight: 307.32502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC=C2N)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC=C2N)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4S/c1-21(19,20)9-6-7-12(13(8-9)16(17)18)15-11-5-3-2-4-10(11)14/h2-8,15H,14H2,1H3