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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](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/c1-4-10(2)14(13(19)9-16-15)17(3)24(22,23)12-7-5-11(6-8-12)18(20)21/h5-10,14H,4H2,1-3H3/b13-9-/t10-,14+/m1/s1