N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2,4-dinitrophenyl)sulfonyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2,4-dinitrophenyl)sulfonyl-ethanamide Openeye Name: 2-(2,4-dinitrophenyl)sulfonyl-N-(1,1-dioxothiolan-3-yl)acetamide CAS Name: 2-(2,4-dinitrophenyl)sulfonyl-N-(1,1-dioxo-3-thiolanyl)acetamide IUPAC Name: 2-(2,4-dinitrophenyl)sulfonyl-N-(1,1-dioxothiolan-3-yl)acetamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-(2,4-dinitrophenyl)sulfonyl-acetamide Formula: C12H13N3O9S2 MolecularWeight: 407.37632

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)CS(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)CS(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O9S2/c16-12(13-8-3-4-25(21,22)6-8)7-26(23,24)11-2-1-9(14(17)18)5-10(11)15(19)20/h1-2,5,8H,3-4,6-7H2,(H,13,16)