butyl 2-(5-phenyl-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: butyl 2-(5-phenyl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: butyl 2-(5-phenyltetrazol-1-yl)acetate CAS Name: 2-(5-phenyl-1-tetrazolyl)acetic acid butyl ester IUPAC Name: butyl 2-(5-phenyltetrazol-1-yl)acetate Traditional Name: 2-(5-phenyltetrazol-1-yl)acetic acid butyl ester Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CN1C(=NN=N1)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)CN1C(=NN=N1)C2=CC=CC=C2

InChI

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