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

Systemtic Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C15H16N4O6 MolecularWeight: 348.31074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(O1)COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O6/c1-10-16-17-14(25-10)9-24-15(20)11-2-3-12(13(8-11)19(21)22)18-4-6-23-7-5-18/h2-3,8H,4-7,9H2,1H3