4-(4-tert-butyl-1,2,3,4-tetrazol-4-ium-2-yl)butan-2-one

Systemtic Name: 4-(4-tert-butyl-1,2,3,4-tetrazol-4-ium-2-yl)butan-2-one Openeye Name: 4-(4-tert-butyltetrazol-4-ium-2-yl)butan-2-one CAS Name: 4-(4-tert-butyl-2-tetrazol-4-iumyl)-2-butanone IUPAC Name: 4-(4-tert-butyltetrazol-4-ium-2-yl)butan-2-one Traditional Name: 4-(4-tert-butyltetrazol-4-ium-2-yl)butan-2-one Formula: C9H17N4O+ MolecularWeight: 197.25748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1N=C[N+](=N1)C(C)(C)C

Isomeric SMILES

CC(=O)CCN1N=C[N+](=N1)C(C)(C)C

InChI

InChI=1S/C9H17N4O/c1-8(14)5-6-13-10-7-12(11-13)9(2,3)4/h7H,5-6H2,1-4H3/q+1