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

Systemtic Name: (4-ethanoylphenyl) 2-[5-(phenoxymethyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: (4-acetylphenyl) 2-[5-(phenoxymethyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(phenoxymethyl)-2-tetrazolyl]acetic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-[5-(phenoxymethyl)tetrazol-2-yl]acetate Traditional Name: 2-[5-(phenoxymethyl)tetrazol-2-yl]acetic acid (4-acetylphenyl) ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)CN2N=C(N=N2)COC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)CN2N=C(N=N2)COC3=CC=CC=C3

InChI

InChI=1S/C18H16N4O4/c1-13(23)14-7-9-16(10-8-14)26-18(24)11-22-20-17(19-21-22)12-25-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3