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

Systemtic Name: [5-(5-bromanylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl 3-methyl-4-nitro-benzoate Openeye Name: [5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-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 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C15H10BrN3O6 MolecularWeight: 408.1604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(O3)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(O3)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H10BrN3O6/c1-8-6-9(2-3-10(8)19(21)22)15(20)23-7-13-17-18-14(25-13)11-4-5-12(16)24-11/h2-6H,7H2,1H3