(5-ethyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (5-ethyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (5-ethyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (5-ethyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-ethyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (5-ethyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C15H18N4O6 MolecularWeight: 350.32662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(O1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC

Isomeric SMILES

CCC1=NN=C(O1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC

InChI

InChI=1S/C15H18N4O6/c1-3-13-17-18-14(25-13)9-24-15(20)11-8-10(19(21)22)4-5-12(11)16-6-7-23-2/h4-5,8,16H,3,6-7,9H2,1-2H3