4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-[(3,4-dimethoxyphenyl)methylamino]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 3-nitro-N-phenyl-4-(veratrylamino)benzenesulfonamide Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H21N3O6S/c1-29-20-11-8-15(12-21(20)30-2)14-22-18-10-9-17(13-19(18)24(25)26)31(27,28)23-16-6-4-3-5-7-16/h3-13,22-23H,14H2,1-2H3