2-[5-(4-ethanoylphenoxy)-3-nitro-1,2,4-triazol-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[5-(4-ethanoylphenoxy)-3-nitro-1,2,4-triazol-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[5-(4-acetylphenoxy)-3-nitro-1,2,4-triazol-1-yl]-1-morpholino-ethanone CAS Name: 2-[5-(4-acetylphenoxy)-3-nitro-1,2,4-triazol-1-yl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[5-(4-acetylphenoxy)-3-nitro-1,2,4-triazol-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[5-(4-acetylphenoxy)-3-nitro-1,2,4-triazol-1-yl]-1-morpholino-ethanone Formula: C16H17N5O6 MolecularWeight: 375.33608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC2=NC(=NN2CC(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC2=NC(=NN2CC(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O6/c1-11(22)12-2-4-13(5-3-12)27-16-17-15(21(24)25)18-20(16)10-14(23)19-6-8-26-9-7-19/h2-5H,6-10H2,1H3