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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NOC(=N2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NOC(=N2)C3=CC=CC=C3C(=O)O

InChI

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