[3-(1,2,3,4-tetrazol-1-yl)phenyl] benzoate

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] benzoate Openeye Name: [3-(tetrazol-1-yl)phenyl] benzoate CAS Name: benzoic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] benzoate Traditional Name: benzoic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C14H10N4O2 MolecularWeight: 266.2548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C14H10N4O2/c19-14(11-5-2-1-3-6-11)20-13-8-4-7-12(9-13)18-10-15-16-17-18/h1-10H