N-[2-[bis(oxidanyl)methyl]-5-(4-nitrophenyl)thiophen-3-yl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[2-[bis(oxidanyl)methyl]-5-(4-nitrophenyl)thiophen-3-yl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[2-(dihydroxymethyl)-5-(4-nitrophenyl)-3-thienyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[2-(dihydroxymethyl)-5-(4-nitrophenyl)-3-thiophenyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[2-(dihydroxymethyl)-5-(4-nitrophenyl)thiophen-3-yl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[2-(dihydroxymethyl)-5-(4-nitrophenyl)-3-thienyl]-2,5-dimethyl-benzenesulfonamide Formula: C19H18N2O6S2 MolecularWeight: 434.48602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(O)O

InChI

InChI=1S/C19H18N2O6S2/c1-11-3-4-12(2)17(9-11)29(26,27)20-15-10-16(28-18(15)19(22)23)13-5-7-14(8-6-13)21(24)25/h3-10,19-20,22-23H,1-2H3