(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 2-bromanyl-5-methoxy-benzoate

Systemtic Name: (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 2-bromanyl-5-methoxy-benzoate Openeye Name: [5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C15H11BrN2O4S MolecularWeight: 395.22784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)OCC2=NN=C(O2)C3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)OCC2=NN=C(O2)C3=CC=CS3

InChI

InChI=1S/C15H11BrN2O4S/c1-20-9-4-5-11(16)10(7-9)15(19)21-8-13-17-18-14(22-13)12-3-2-6-23-12/h2-7H,8H2,1H3