(3S)-N-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: (3S)-N-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: (3S)-N-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)-1,1-dioxo-thiolan-3-amine CAS Name: (3S)-N-methyl-N-(4-methylsulfonyl-2-nitrophenyl)-1,1-dioxo-3-thiolanamine IUPAC Name: (3S)-N-methyl-N-(4-methylsulfonyl-2-nitrophenyl)-1,1-dioxothiolan-3-amine Traditional Name: [(3S)-1,1-diketothiolan-3-yl]-(4-mesyl-2-nitro-phenyl)-methyl-amine Formula: C12H16N2O6S2 MolecularWeight: 348.39524

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O6S2/c1-13(9-5-6-22(19,20)8-9)11-4-3-10(21(2,17)18)7-12(11)14(15)16/h3-4,7,9H,5-6,8H2,1-2H3/t9-/m0/s1