3-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)benzoic acid

Systemtic Name: 3-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)benzoic acid Openeye Name: 3-(1-tert-butyltetrazol-5-yl)benzoic acid CAS Name: 3-(1-tert-butyl-5-tetrazolyl)benzoic acid IUPAC Name: 3-(1-tert-butyltetrazol-5-yl)benzoic acid Traditional Name: 3-(1-tert-butyltetrazol-5-yl)benzoic acid Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C12H14N4O2/c1-12(2,3)16-10(13-14-15-16)8-5-4-6-9(7-8)11(17)18/h4-7H,1-3H3,(H,17,18)