N-(2,4-dimethylphenyl)-3-nitro-4-[[(2R)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]benzenesulfonamide

Systemtic Name: N-(2,4-dimethylphenyl)-3-nitro-4-[[(2R)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]benzenesulfonamide Openeye Name: N-(2,4-dimethylphenyl)-4-[[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-(2,4-dimethylphenyl)-4-[[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-(2,4-dimethylphenyl)-4-[[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitrobenzenesulfonamide Traditional Name: N-(2,4-dimethylphenyl)-4-[[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitro-benzenesulfonamide Formula: C22H22N4O7S MolecularWeight: 486.49768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC[C@@H](C3=CC=C(C=C3)[N+](=O)[O-])O)[N+](=O)[O-])C

InChI

InChI=1S/C22H22N4O7S/c1-14-3-9-19(15(2)11-14)24-34(32,33)18-8-10-20(21(12-18)26(30)31)23-13-22(27)16-4-6-17(7-5-16)25(28)29/h3-12,22-24,27H,13H2,1-2H3/t22-/m0/s1