2-(5-ethanoyl-1-phenyl-1,2,3,4-tetrazol-1-ium-1-yl)ethanoate

Systemtic Name: 2-(5-ethanoyl-1-phenyl-1,2,3,4-tetrazol-1-ium-1-yl)ethanoate Openeye Name: 2-(5-acetyl-1-phenyl-tetrazol-1-ium-1-yl)acetate CAS Name: 2-(5-acetyl-1-phenyl-1-tetrazol-1-iumyl)acetate IUPAC Name: 2-(5-acetyl-1-phenyltetrazol-1-ium-1-yl)acetate Traditional Name: 2-(5-acetyl-1-phenyl-tetrazol-1-ium-1-yl)acetate Formula: C11H10N4O3 MolecularWeight: 246.2221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN=N[N+]1(CC(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=NN=N[N+]1(CC(=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C11H10N4O3/c1-8(16)11-12-13-14-15(11,7-10(17)18)9-5-3-2-4-6-9/h2-6H,7H2,1H3