(E)-1-diazonio-3-(2-methyl-1,3-dithiolan-2-yl)but-1-en-2-olate

Systemtic Name: (E)-1-diazonio-3-(2-methyl-1,3-dithiolan-2-yl)but-1-en-2-olate Openeye Name: (E)-1-diazonio-3-(2-methyl-1,3-dithiolan-2-yl)but-1-en-2-olate CAS Name: (E)-1-diazonio-3-(2-methyl-1,3-dithiolan-2-yl)-1-buten-2-olate IUPAC Name: (E)-1-diazonio-3-(2-methyl-1,3-dithiolan-2-yl)but-1-en-2-olate Traditional Name: (E)-1-diazonio-3-(2-methyl-1,3-dithiolan-2-yl)but-1-en-2-olate Formula: C8H12N2OS2 MolecularWeight: 216.32368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C[N+]#N)[O-])C1(SCCS1)C

Isomeric SMILES

CC(/C(=C\[N+]#N)/[O-])C1(SCCS1)C

InChI

InChI=1S/C8H12N2OS2/c1-6(7(11)5-10-9)8(2)12-3-4-13-8/h5-6H,3-4H2,1-2H3/b7-5+