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

Systemtic Name: 4-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]benzoate Openeye Name: 4-[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]benzoate CAS Name: 4-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]benzoate IUPAC Name: 4-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]benzoate Traditional Name: 4-[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]benzoate Formula: C16H11N2O3- MolecularWeight: 279.27014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(O2)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(O2)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H12N2O3/c1-10-3-2-4-13(9-10)15-18-17-14(21-15)11-5-7-12(8-6-11)16(19)20/h2-9H,1H3,(H,19,20)/p-1