(E)-1-diazonio-5-(2,4-dinitrophenyl)sulfanyl-pent-1-en-2-olate

Systemtic Name: (E)-1-diazonio-5-(2,4-dinitrophenyl)sulfanyl-pent-1-en-2-olate Openeye Name: (E)-1-diazonio-5-(2,4-dinitrophenyl)sulfanyl-pent-1-en-2-olate CAS Name: (E)-1-diazonio-5-[(2,4-dinitrophenyl)thio]-1-penten-2-olate IUPAC Name: (E)-1-diazonio-5-(2,4-dinitrophenyl)sulfanylpent-1-en-2-olate Traditional Name: (E)-1-diazonio-5-[(2,4-dinitrophenyl)thio]pent-1-en-2-olate Formula: C11H10N4O5S MolecularWeight: 310.2859

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCCC/C(=C\[N+]#N)/[O-]

InChI

InChI=1S/C11H10N4O5S/c12-13-7-9(16)2-1-5-21-11-4-3-8(14(17)18)6-10(11)15(19)20/h3-4,6-7H,1-2,5H2/b9-7+