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

Systemtic Name: 4-[(2-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl]benzoic acid Openeye Name: 4-[(2-tert-butyltetrazol-5-yl)methyl]benzoic acid CAS Name: 4-[(2-tert-butyl-5-tetrazolyl)methyl]benzoic acid IUPAC Name: 4-[(2-tert-butyltetrazol-5-yl)methyl]benzoic acid Traditional Name: 4-[(2-tert-butyltetrazol-5-yl)methyl]benzoic acid Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1N=C(N=N1)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)N1N=C(N=N1)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H16N4O2/c1-13(2,3)17-15-11(14-16-17)8-9-4-6-10(7-5-9)12(18)19/h4-7H,8H2,1-3H3,(H,18,19)