(Z)-3-(6-aminopurin-9-yl)-1-diazonio-prop-1-en-2-olate

Systemtic Name: (Z)-3-(6-aminopurin-9-yl)-1-diazonio-prop-1-en-2-olate Openeye Name: (Z)-3-(6-aminopurin-9-yl)-1-diazonio-prop-1-en-2-olate CAS Name: (Z)-3-(6-aminopurin-9-yl)-1-diazonio-1-propen-2-olate IUPAC Name: (Z)-3-(6-aminopurin-9-yl)-1-diazonioprop-1-en-2-olate Traditional Name: (Z)-3-adenin-9-yl-1-diazonio-prop-1-en-2-olate Formula: C8H7N7O MolecularWeight: 217.18748

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CC(=C[N+]#N)[O-]

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C8H7N7O/c9-7-6-8(12-3-11-7)15(4-13-6)2-5(16)1-14-10/h1,3-4H,2H2,(H2-,9,11,12,16)/b5-1-