(E)-4-(1-benzothiophen-3-yl)-1-diazonio-but-1-en-2-olate

Systemtic Name: (E)-4-(1-benzothiophen-3-yl)-1-diazonio-but-1-en-2-olate Openeye Name: (E)-4-(benzothiophen-3-yl)-1-diazonio-but-1-en-2-olate CAS Name: (E)-4-(1-benzothiophen-3-yl)-1-diazonio-1-buten-2-olate IUPAC Name: (E)-4-(1-benzothiophen-3-yl)-1-diazoniobut-1-en-2-olate Traditional Name: (E)-4-(benzothiophen-3-yl)-1-diazonio-but-1-en-2-olate Formula: C12H10N2OS MolecularWeight: 230.2856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)CCC(=C[N+]#N)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)CC/C(=C\[N+]#N)/[O-]

InChI

InChI=1S/C12H10N2OS/c13-14-7-10(15)6-5-9-8-16-12-4-2-1-3-11(9)12/h1-4,7-8H,5-6H2/b10-7+