2-(2,4-dinitrophenyl)sulfanyl-1-morpholin-4-yl-ethanone

Systemtic Name: 2-(2,4-dinitrophenyl)sulfanyl-1-morpholin-4-yl-ethanone Openeye Name: 2-(2,4-dinitrophenyl)sulfanyl-1-morpholino-ethanone CAS Name: 2-[(2,4-dinitrophenyl)thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-(2,4-dinitrophenyl)sulfanyl-1-morpholin-4-ylethanone Traditional Name: 2-[(2,4-dinitrophenyl)thio]-1-morpholino-ethanone Formula: C12H13N3O6S MolecularWeight: 327.31312

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O6S/c16-12(13-3-5-21-6-4-13)8-22-11-2-1-9(14(17)18)7-10(11)15(19)20/h1-2,7H,3-6,8H2