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

Systemtic Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-isobutoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(2-methylpropoxy)benzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-methoxy-benzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C21H21BrN2O5 MolecularWeight: 461.30584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2O5/c1-13(2)11-27-17-9-6-15(10-18(17)26-3)21(25)28-12-19-23-24-20(29-19)14-4-7-16(22)8-5-14/h4-10,13H,11-12H2,1-3H3