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

Systemtic Name: 1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl 3-bromanyl-5-methoxy-4-propoxy-benzoate Openeye Name: 1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl 3-bromo-5-methoxy-4-propoxy-benzoate CAS Name: 3-bromo-5-methoxy-4-propoxybenzoic acid 1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl ester IUPAC Name: 1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl 3-bromo-5-methoxy-4-propoxybenzoate Traditional Name: 3-bromo-5-methoxy-4-propoxy-benzoic acid 1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl ester Formula: C19H19BrN2O5S MolecularWeight: 467.33356

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)OC(C)C2=NN=C(O2)C3=CC=CS3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)OC(C)C2=NN=C(O2)C3=CC=CS3)OC

InChI

InChI=1S/C19H19BrN2O5S/c1-4-7-25-16-13(20)9-12(10-14(16)24-3)19(23)26-11(2)17-21-22-18(27-17)15-6-5-8-28-15/h5-6,8-11H,4,7H2,1-3H3