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

Systemtic Name: 2-[4-[2-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]phenoxy]ethanoate Openeye Name: 2-[4-(2-benzyltetrazol-5-yl)phenoxy]acetate CAS Name: 2-[4-[2-(phenylmethyl)-5-tetrazolyl]phenoxy]acetate IUPAC Name: 2-[4-(2-benzyltetrazol-5-yl)phenoxy]acetate Traditional Name: 2-[4-(2-benzyltetrazol-5-yl)phenoxy]acetate Formula: C16H13N4O3- MolecularWeight: 309.29942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=C(C=C3)OCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=C(C=C3)OCC(=O)[O-]

InChI

InChI=1S/C16H14N4O3/c21-15(22)11-23-14-8-6-13(7-9-14)16-17-19-20(18-16)10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,21,22)/p-1