(5-bromanyl-2-methoxy-phenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl 3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoate CAS Name: 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Traditional Name: 3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionic acid (5-bromo-2-methoxy-benzyl) ester Formula: C17H15BrN2O5S MolecularWeight: 439.2804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)COC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)COC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H15BrN2O5S/c1-23-13-5-4-12(18)9-11(13)10-24-15(21)6-7-20-17(22)25-16(19-20)14-3-2-8-26-14/h2-5,8-9H,6-7,10H2,1H3