5-methoxy-4-methyl-2-[(2-methylsulfonyl-4-nitro-phenyl)diazenyl]benzenediazonium sulfate

Systemtic Name: 5-methoxy-4-methyl-2-[(2-methylsulfonyl-4-nitro-phenyl)diazenyl]benzenediazonium sulfate Openeye Name: 5-methoxy-4-methyl-2-(2-methylsulfonyl-4-nitro-phenyl)azo-benzenediazonium sulfate CAS Name: 5-methoxy-4-methyl-2-(2-methylsulfonyl-4-nitrophenyl)azobenzenediazonium sulfate IUPAC Name: 5-methoxy-4-methyl-2-[(2-methylsulfonyl-4-nitrophenyl)diazenyl]benzenediazonium sulfate Traditional Name: 2-(2-mesyl-4-nitro-phenyl)azo-5-methoxy-4-methyl-benzenediazonium sulfate Formula: C15H14N5O9S2- MolecularWeight: 472.42976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OC)[N+]#N)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1OC)[N+]#N)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C15H14N5O5S.H2O4S/c1-9-6-13(12(17-16)8-14(9)25-2)19-18-11-5-4-10(20(21)22)7-15(11)26(3,23)24;1-5(2,3)4/h4-8H,1-3H3;(H2,1,2,3,4)/q+1;/p-2