(Z,3S)-1-diazonio-5-methyl-3-[methyl-(4-nitrophenyl)sulfonyl-amino]hex-1-en-2-olate

Systemtic Name: (Z,3S)-1-diazonio-5-methyl-3-[methyl-(4-nitrophenyl)sulfonyl-amino]hex-1-en-2-olate Openeye Name: (Z,3S)-1-diazonio-5-methyl-3-[methyl-(4-nitrophenyl)sulfonyl-amino]hex-1-en-2-olate CAS Name: (Z,3S)-1-diazonio-5-methyl-3-[methyl-(4-nitrophenyl)sulfonylamino]-1-hexen-2-olate IUPAC Name: (Z,3S)-1-diazonio-5-methyl-3-[methyl-(4-nitrophenyl)sulfonylamino]hex-1-en-2-olate Traditional Name: (Z,3S)-1-diazonio-5-methyl-3-[methyl(nosyl)amino]hex-1-en-2-olate Formula: C14H18N4O5S MolecularWeight: 354.38152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](/C(=C/[N+]#N)/[O-])N(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O5S/c1-10(2)8-13(14(19)9-16-15)17(3)24(22,23)12-6-4-11(5-7-12)18(20)21/h4-7,9-10,13H,8H2,1-3H3/b14-9-/t13-/m0/s1