N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-methylsulfonyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-methylsulfonyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-methylsulfonyl-2-nitro-phenoxy)acetamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-(4-methylsulfonyl-2-nitrophenoxy)acetamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-methylsulfonyl-2-nitrophenoxy)acetamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-2-(4-mesyl-2-nitro-phenoxy)acetamide Formula: C13H16N2O8S2 MolecularWeight: 392.40474

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)NC2CCS(=O)(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N[C@H]2CCS(=O)(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O8S2/c1-24(19,20)10-2-3-12(11(6-10)15(17)18)23-7-13(16)14-9-4-5-25(21,22)8-9/h2-3,6,9H,4-5,7-8H2,1H3,(H,14,16)/t9-/m0/s1