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

Systemtic Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 4-(dimethylamino)-3-nitro-benzoate Openeye Name: [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid [5-(2-furanyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C16H14N4O6 MolecularWeight: 358.30556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)OCC2=NN=C(O2)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)OCC2=NN=C(O2)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O6/c1-19(2)11-6-5-10(8-12(11)20(22)23)16(21)25-9-14-17-18-15(26-14)13-4-3-7-24-13/h3-8H,9H2,1-2H3