3-[5-(4-cyanophenyl)-1,2,4-oxadiazol-3-yl]benzoate

Systemtic Name: 3-[5-(4-cyanophenyl)-1,2,4-oxadiazol-3-yl]benzoate Openeye Name: 3-[5-(4-cyanophenyl)-1,2,4-oxadiazol-3-yl]benzoate CAS Name: 3-[5-(4-cyanophenyl)-1,2,4-oxadiazol-3-yl]benzoate IUPAC Name: 3-[5-(4-cyanophenyl)-1,2,4-oxadiazol-3-yl]benzoate Traditional Name: 3-[5-(4-cyanophenyl)-1,2,4-oxadiazol-3-yl]benzoate Formula: C16H8N3O3- MolecularWeight: 290.25302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)[O-])C2=NOC(=N2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)[O-])C2=NOC(=N2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H9N3O3/c17-9-10-4-6-11(7-5-10)15-18-14(19-22-15)12-2-1-3-13(8-12)16(20)21/h1-8H,(H,20,21)/p-1