N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: N-[2,5-dimethyl-4-(p-tolylsulfonylamino)phenyl]-2-methoxy-5-nitro-benzenesulfonamide CAS Name: N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: N-[2,5-dimethyl-4-(tosylamino)phenyl]-2-methoxy-5-nitro-benzenesulfonamide Formula: C22H23N3O7S2 MolecularWeight: 505.56392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O7S2/c1-14-5-8-18(9-6-14)33(28,29)23-19-11-16(3)20(12-15(19)2)24-34(30,31)22-13-17(25(26)27)7-10-21(22)32-4/h5-13,23-24H,1-4H3