N-methyl-N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]-3-nitro-benzenesulfonamide CAS Name: N-methyl-N-[(3R)-3-methyl-1,1-dioxo-3-thiolanyl]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[(3R)-1,1-diketo-3-methyl-thiolan-3-yl]-N-methyl-3-nitro-benzenesulfonamide Formula: C12H16N2O6S2 MolecularWeight: 348.39524

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)N(C)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O6S2/c1-12(6-7-21(17,18)9-12)13(2)22(19,20)11-5-3-4-10(8-11)14(15)16/h3-5,8H,6-7,9H2,1-2H3/t12-/m1/s1