N-[(1R)-1-[3-ethenyl-1-(4-methylphenyl)sulfonyl-indol-4-yl]-3-methyl-but-3-enyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(1R)-1-[3-ethenyl-1-(4-methylphenyl)sulfonyl-indol-4-yl]-3-methyl-but-3-enyl]-2-nitro-benzenesulfonamide Openeye Name: N-[(1R)-3-methyl-1-[1-(p-tolylsulfonyl)-3-vinyl-indol-4-yl]but-3-enyl]-2-nitro-benzenesulfonamide CAS Name: N-[(1R)-1-[3-ethenyl-1-(4-methylphenyl)sulfonyl-4-indolyl]-3-methylbut-3-enyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(1R)-1-[3-ethenyl-1-(4-methylphenyl)sulfonylindol-4-yl]-3-methylbut-3-enyl]-2-nitrobenzenesulfonamide Traditional Name: N-[(1R)-3-methyl-1-(1-tosyl-3-vinyl-indol-4-yl)but-3-enyl]-2-nitro-benzenesulfonamide Formula: C28H27N3O6S2 MolecularWeight: 565.66048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C(C=CC=C32)C(CC(=C)C)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-])C=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C(C=CC=C32)[C@@H](CC(=C)C)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-])C=C

InChI

InChI=1S/C28H27N3O6S2/c1-5-21-18-30(39(36,37)22-15-13-20(4)14-16-22)26-11-8-9-23(28(21)26)24(17-19(2)3)29-38(34,35)27-12-7-6-10-25(27)31(32)33/h5-16,18,24,29H,1-2,17H2,3-4H3/t24-/m1/s1