2-[5-(4-ethylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate

Systemtic Name: 2-[5-(4-ethylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: 2-[5-(4-ethylphenyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(4-ethylphenyl)-2-tetrazolyl]acetate IUPAC Name: 2-[5-(4-ethylphenyl)tetrazol-2-yl]acetate Traditional Name: 2-[5-(4-ethylphenyl)tetrazol-2-yl]acetate Formula: C11H11N4O2- MolecularWeight: 231.23064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)[O-]

InChI

InChI=1S/C11H12N4O2/c1-2-8-3-5-9(6-4-8)11-12-14-15(13-11)7-10(16)17/h3-6H,2,7H2,1H3,(H,16,17)/p-1