(Z,3S)-5-methyl-3-[methyl-(4-nitrophenyl)sulfonyl-amino]-2-oxidanyl-hex-1-ene-1-diazonium

Systemtic Name: (Z,3S)-5-methyl-3-[methyl-(4-nitrophenyl)sulfonyl-amino]-2-oxidanyl-hex-1-ene-1-diazonium Openeye Name: (Z,3S)-2-hydroxy-5-methyl-3-[methyl-(4-nitrophenyl)sulfonyl-amino]hex-1-ene-1-diazonium CAS Name: (Z,3S)-2-hydroxy-5-methyl-3-[methyl-(4-nitrophenyl)sulfonylamino]-1-hexene-1-diazonium IUPAC Name: (Z,3S)-2-hydroxy-5-methyl-3-[methyl-(4-nitrophenyl)sulfonylamino]hex-1-ene-1-diazonium Traditional Name: (Z,3S)-2-hydroxy-5-methyl-3-[methyl(nosyl)amino]hex-1-ene-1-diazonium Formula: C14H19N4O5S+ MolecularWeight: 355.38946

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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/p+1/b14-9-/t13-/m0/s1