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

Systemtic Name: [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-nitrothiophene-2-carboxylate Openeye Name: [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C14H8BrN3O5S MolecularWeight: 410.19942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN=C(O2)COC(=O)C3=CC=C(S3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN=C(O2)COC(=O)C3=CC=C(S3)[N+](=O)[O-])Br

InChI

InChI=1S/C14H8BrN3O5S/c15-9-4-2-1-3-8(9)13-17-16-11(23-13)7-22-14(19)10-5-6-12(24-10)18(20)21/h1-6H,7H2