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

Systemtic Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-methyl-1-benzofuran-2-carboxylate Openeye Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic 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-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C19H13BrN2O4 MolecularWeight: 413.22152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OCC3=NN=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OCC3=NN=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H13BrN2O4/c1-11-14-4-2-3-5-15(14)25-17(11)19(23)24-10-16-21-22-18(26-16)12-6-8-13(20)9-7-12/h2-9H,10H2,1H3