(E)-4-(1,3-benzodioxol-5-yl)-1-diazonio-but-1-en-2-olate

Systemtic Name: (E)-4-(1,3-benzodioxol-5-yl)-1-diazonio-but-1-en-2-olate Openeye Name: (E)-4-(1,3-benzodioxol-5-yl)-1-diazonio-but-1-en-2-olate CAS Name: (E)-4-(1,3-benzodioxol-5-yl)-1-diazonio-1-buten-2-olate IUPAC Name: (E)-4-(1,3-benzodioxol-5-yl)-1-diazoniobut-1-en-2-olate Traditional Name: (E)-4-(1,3-benzodioxol-5-yl)-1-diazonio-but-1-en-2-olate Formula: C11H10N2O3 MolecularWeight: 218.2087

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=C[N+]#N)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC/C(=C\[N+]#N)/[O-]

InChI

InChI=1S/C11H10N2O3/c12-13-6-9(14)3-1-8-2-4-10-11(5-8)16-7-15-10/h2,4-6H,1,3,7H2/b9-6+