N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-methyl-3-nitro-N-propyl-benzenesulfonamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-methyl-3-nitro-N-propyl-benzenesulfonamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-4-methyl-3-nitro-N-propyl-benzenesulfonamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-4-methyl-3-nitro-N-propylbenzenesulfonamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-4-methyl-3-nitro-N-propylbenzenesulfonamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-4-methyl-3-nitro-N-propyl-benzenesulfonamide Formula: C14H20N2O6S2 MolecularWeight: 376.4484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O6S2/c1-3-7-15(12-6-8-23(19,20)10-12)24(21,22)13-5-4-11(2)14(9-13)16(17)18/h4-5,9,12H,3,6-8,10H2,1-2H3/t12-/m0/s1