3-methyl-4-(4-methylphenyl)sulfonyl-6-nitro-benzene-1,2-diamine

Systemtic Name: 3-methyl-4-(4-methylphenyl)sulfonyl-6-nitro-benzene-1,2-diamine Openeye Name: 3-methyl-6-nitro-4-(p-tolylsulfonyl)benzene-1,2-diamine CAS Name: 3-methyl-4-(4-methylphenyl)sulfonyl-6-nitrobenzene-1,2-diamine IUPAC Name: 3-methyl-4-(4-methylphenyl)sulfonyl-6-nitrobenzene-1,2-diamine Traditional Name: (2-amino-3-methyl-6-nitro-4-tosyl-phenyl)amine Formula: C14H15N3O4S MolecularWeight: 321.3516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4S/c1-8-3-5-10(6-4-8)22(20,21)12-7-11(17(18)19)14(16)13(15)9(12)2/h3-7H,15-16H2,1-2H3