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

Systemtic Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(furan-2-ylmethylamino)benzoate Openeye Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(2-furylmethylamino)benzoate CAS Name: 2-(2-furanylmethylamino)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 2-(furan-2-ylmethylamino)benzoate Traditional Name: 2-(2-furfurylamino)benzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)Br)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)Br)NCC4=CC=CO4

InChI

InChI=1S/C21H16BrN3O4/c22-15-9-7-14(8-10-15)20-25-24-19(29-20)13-28-21(26)17-5-1-2-6-18(17)23-12-16-4-3-11-27-16/h1-11,23H,12-13H2