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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C(=NN=N1)C2=CC=NC=C2

Isomeric SMILES

CC(C)(C)C(=O)OCN1C(=NN=N1)C2=CC=NC=C2

InChI

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