2-(4-methylsulfanyl-2-nitro-phenoxy)-1-morpholin-4-yl-ethanone

Systemtic Name: 2-(4-methylsulfanyl-2-nitro-phenoxy)-1-morpholin-4-yl-ethanone Openeye Name: 2-(4-methylsulfanyl-2-nitro-phenoxy)-1-morpholino-ethanone CAS Name: 2-[4-(methylthio)-2-nitrophenoxy]-1-(4-morpholinyl)ethanone IUPAC Name: 2-(4-methylsulfanyl-2-nitrophenoxy)-1-morpholin-4-ylethanone Traditional Name: 2-[4-(methylthio)-2-nitro-phenoxy]-1-morpholino-ethanone Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)OCC(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC(=C(C=C1)OCC(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O5S/c1-21-10-2-3-12(11(8-10)15(17)18)20-9-13(16)14-4-6-19-7-5-14/h2-3,8H,4-7,9H2,1H3