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

Systemtic Name: ethyl 2-[5-(4-ethoxyphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(4-ethoxyphenyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(4-ethoxyphenyl)-2-tetrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-ethoxyphenyl)tetrazol-2-yl]acetate Traditional Name: 2-(5-p-phenetyltetrazol-2-yl)acetic acid ethyl ester Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC

InChI

InChI=1S/C13H16N4O3/c1-3-19-11-7-5-10(6-8-11)13-14-16-17(15-13)9-12(18)20-4-2/h5-8H,3-4,9H2,1-2H3