(4-ethanoylphenyl) 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (4-ethanoylphenyl) 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (4-acetylphenyl) 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid (4-acetylphenyl) ester Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)N3C=NN=N3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)N3C=NN=N3

InChI

InChI=1S/C16H12N4O3/c1-11(21)12-5-7-15(8-6-12)23-16(22)13-3-2-4-14(9-13)20-10-17-18-19-20/h2-10H,1H3