2-(5-tert-butyl-1-ethanoyl-1,2,3,4-tetrazol-1-ium-1-yl)ethanoic acid

Systemtic Name: 2-(5-tert-butyl-1-ethanoyl-1,2,3,4-tetrazol-1-ium-1-yl)ethanoic acid Openeye Name: 2-(1-acetyl-5-tert-butyl-tetrazol-1-ium-1-yl)acetic acid CAS Name: 2-(1-acetyl-5-tert-butyl-1-tetrazol-1-iumyl)acetic acid IUPAC Name: 2-(1-acetyl-5-tert-butyltetrazol-1-ium-1-yl)acetic acid Traditional Name: 2-(1-acetyl-5-tert-butyl-tetrazol-1-ium-1-yl)acetic acid Formula: C9H15N4O3+ MolecularWeight: 227.2404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+]1(C(=NN=N1)C(C)(C)C)CC(=O)O

Isomeric SMILES

CC(=O)[N+]1(C(=NN=N1)C(C)(C)C)CC(=O)O

InChI

InChI=1S/C9H14N4O3/c1-6(14)13(5-7(15)16)8(9(2,3)4)10-11-12-13/h5H2,1-4H3/p+1