(E)-1-(3-chloranyl-4-methyl-5-sulfamoyl-phenyl)-2-diazonio-ethenolate

Systemtic Name: (E)-1-(3-chloranyl-4-methyl-5-sulfamoyl-phenyl)-2-diazonio-ethenolate Openeye Name: (E)-1-(3-chloro-4-methyl-5-sulfamoyl-phenyl)-2-diazonio-ethenolate CAS Name: (E)-1-(3-chloro-4-methyl-5-sulfamoylphenyl)-2-diazonioethenolate IUPAC Name: (E)-1-(3-chloro-4-methyl-5-sulfamoylphenyl)-2-diazonioethenolate Traditional Name: (E)-1-(3-chloro-4-methyl-5-sulfamoyl-phenyl)-2-diazonio-ethenolate Formula: C9H8ClN3O3S MolecularWeight: 273.69612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)C(=C[N+]#N)[O-])S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1Cl)/C(=C\[N+]#N)/[O-])S(=O)(=O)N

InChI

InChI=1S/C9H8ClN3O3S/c1-5-7(10)2-6(8(14)4-13-11)3-9(5)17(12,15)16/h2-4H,1H3,(H2-,12,14,15,16)/b8-4+