4-methoxy-N-[4-[(4-methoxy-3-nitro-phenyl)amino]phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methoxy-N-[4-[(4-methoxy-3-nitro-phenyl)amino]phenyl]-3-nitro-benzenesulfonamide Openeye Name: 4-methoxy-N-[4-(4-methoxy-3-nitro-anilino)phenyl]-3-nitro-benzenesulfonamide CAS Name: 4-methoxy-N-[4-(4-methoxy-3-nitroanilino)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methoxy-N-[4-(4-methoxy-3-nitroanilino)phenyl]-3-nitrobenzenesulfonamide Traditional Name: 4-methoxy-N-[4-(4-methoxy-3-nitro-anilino)phenyl]-3-nitro-benzenesulfonamide Formula: C20H18N4O8S MolecularWeight: 474.44392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O8S/c1-31-19-9-7-15(11-17(19)23(25)26)21-13-3-5-14(6-4-13)22-33(29,30)16-8-10-20(32-2)18(12-16)24(27)28/h3-12,21-22H,1-2H3