3-[5-(phenylmethyl)-1,2,4-oxadiazol-3-yl]benzoic acid

Systemtic Name: 3-[5-(phenylmethyl)-1,2,4-oxadiazol-3-yl]benzoic acid Openeye Name: 3-(5-benzyl-1,2,4-oxadiazol-3-yl)benzoic acid CAS Name: 3-[5-(phenylmethyl)-1,2,4-oxadiazol-3-yl]benzoic acid IUPAC Name: 3-(5-benzyl-1,2,4-oxadiazol-3-yl)benzoic acid Traditional Name: 3-(5-benzyl-1,2,4-oxadiazol-3-yl)benzoic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(=NO2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(=NO2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C16H12N2O3/c19-16(20)13-8-4-7-12(10-13)15-17-14(21-18-15)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H,19,20)