N-(7-chloranyl-2-oxidanylidene-1,3-benzoxathiol-5-yl)-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(7-chloranyl-2-oxidanylidene-1,3-benzoxathiol-5-yl)-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-(7-chloro-2-oxo-1,3-benzoxathiol-5-yl)-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-(7-chloro-2-oxo-1,3-benzoxathiol-5-yl)-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-(7-chloro-2-oxo-1,3-benzoxathiol-5-yl)-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-(7-chloro-2-keto-1,3-benzoxathiol-5-yl)-2-methyl-5-nitro-benzenesulfonamide Formula: C14H9ClN2O6S2 MolecularWeight: 400.81406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(C(=C2)Cl)OC(=O)S3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(C(=C2)Cl)OC(=O)S3

InChI

InChI=1S/C14H9ClN2O6S2/c1-7-2-3-9(17(19)20)6-12(7)25(21,22)16-8-4-10(15)13-11(5-8)24-14(18)23-13/h2-6,16H,1H3