[5-(5-bromanylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: [5-(5-bromanylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: [5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid [5-(5-bromo-2-furanyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(5-bromofuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid [5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C18H15BrN4O7 MolecularWeight: 479.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=NN=C(O3)C4=CC=C(O4)Br

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=NN=C(O3)C4=CC=C(O4)Br

InChI

InChI=1S/C18H15BrN4O7/c19-15-4-3-14(29-15)17-21-20-16(30-17)10-28-18(24)12-9-11(23(25)26)1-2-13(12)22-5-7-27-8-6-22/h1-4,9H,5-8,10H2