[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2,3,4-trimethoxybenzoate

Systemtic Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2,3,4-trimethoxybenzoate Openeye Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C19H17BrN2O6 MolecularWeight: 449.25208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O6/c1-24-14-9-8-13(16(25-2)17(14)26-3)19(23)27-10-15-21-22-18(28-15)11-4-6-12(20)7-5-11/h4-9H,10H2,1-3H3