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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CSC=C3)Br

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CSC=C3)Br

InChI

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