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

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-cyanobenzoate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H10BrN3O3 MolecularWeight: 384.1836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H10BrN3O3/c18-14-3-1-2-13(8-14)16-20-15(24-21-16)10-23-17(22)12-6-4-11(9-19)5-7-12/h1-8H,10H2