N-(3-chlorophenyl)-4-methyl-N-(4-methyl-3-nitro-phenyl)sulfonyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(3-chlorophenyl)-4-methyl-N-(4-methyl-3-nitro-phenyl)sulfonyl-3-nitro-benzenesulfonamide Openeye Name: N-(3-chlorophenyl)-4-methyl-N-(4-methyl-3-nitro-phenyl)sulfonyl-3-nitro-benzenesulfonamide CAS Name: N-(3-chlorophenyl)-4-methyl-N-(4-methyl-3-nitrophenyl)sulfonyl-3-nitrobenzenesulfonamide IUPAC Name: N-(3-chlorophenyl)-4-methyl-N-(4-methyl-3-nitrophenyl)sulfonyl-3-nitrobenzenesulfonamide Traditional Name: N-(3-chlorophenyl)-4-methyl-N-(4-methyl-3-nitro-phenyl)sulfonyl-3-nitro-benzenesulfonamide Formula: C20H16ClN3O8S2 MolecularWeight: 525.93934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClN3O8S2/c1-13-6-8-17(11-19(13)22(25)26)33(29,30)24(16-5-3-4-15(21)10-16)34(31,32)18-9-7-14(2)20(12-18)23(27)28/h3-12H,1-2H3