butyl 5-(4-nitrophenyl)-1,3,4-oxadiazole-2-carboxylate

Systemtic Name: butyl 5-(4-nitrophenyl)-1,3,4-oxadiazole-2-carboxylate Openeye Name: butyl 5-(4-nitrophenyl)-1,3,4-oxadiazole-2-carboxylate CAS Name: 5-(4-nitrophenyl)-1,3,4-oxadiazole-2-carboxylic acid butyl ester IUPAC Name: butyl 5-(4-nitrophenyl)-1,3,4-oxadiazole-2-carboxylate Traditional Name: 5-(4-nitrophenyl)-1,3,4-oxadiazole-2-carboxylic acid butyl ester Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O5/c1-2-3-8-20-13(17)12-15-14-11(21-12)9-4-6-10(7-5-9)16(18)19/h4-7H,2-3,8H2,1H3