(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-bromanylbenzoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-bromanylbenzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C16H11BrN2O3 MolecularWeight: 359.17414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H11BrN2O3/c17-13-8-6-12(7-9-13)16(20)21-10-14-18-15(19-22-14)11-4-2-1-3-5-11/h1-9H,10H2