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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC=CC=C3C(=O)[O-]

InChI

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