N-(furan-2-ylmethyl)-2,3-dimethyl-N-(4-methylphenyl)-5-nitro-benzenesulfonamide

Systemtic Name: N-(furan-2-ylmethyl)-2,3-dimethyl-N-(4-methylphenyl)-5-nitro-benzenesulfonamide Openeye Name: N-(2-furylmethyl)-2,3-dimethyl-5-nitro-N-(p-tolyl)benzenesulfonamide CAS Name: N-(2-furanylmethyl)-2,3-dimethyl-N-(4-methylphenyl)-5-nitrobenzenesulfonamide IUPAC Name: N-(furan-2-ylmethyl)-2,3-dimethyl-N-(4-methylphenyl)-5-nitrobenzenesulfonamide Traditional Name: N-(2-furfuryl)-2,3-dimethyl-5-nitro-N-(p-tolyl)benzenesulfonamide Formula: C20H20N2O5S MolecularWeight: 400.4482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC=CO2)S(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC=CO2)S(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H20N2O5S/c1-14-6-8-17(9-7-14)21(13-19-5-4-10-27-19)28(25,26)20-12-18(22(23)24)11-15(2)16(20)3/h4-12H,13H2,1-3H3