(5-pyridin-4-yl-1,2,3,4-tetrazol-5-yl)methyl 2,2-dimethylpropanoate

Systemtic Name: (5-pyridin-4-yl-1,2,3,4-tetrazol-5-yl)methyl 2,2-dimethylpropanoate Openeye Name: [5-(4-pyridyl)tetrazol-5-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (5-pyridin-4-yl-5-tetrazolyl)methyl ester IUPAC Name: (5-pyridin-4-yltetrazol-5-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [5-(4-pyridyl)tetrazol-5-yl]methyl ester Formula: C12H15N5O2 MolecularWeight: 261.2798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC1(N=NN=N1)C2=CC=NC=C2

Isomeric SMILES

CC(C)(C)C(=O)OCC1(N=NN=N1)C2=CC=NC=C2

InChI

InChI=1S/C12H15N5O2/c1-11(2,3)10(18)19-8-12(14-16-17-15-12)9-4-6-13-7-5-9/h4-7H,8H2,1-3H3