4-[(3-methoxy-4-phenylmethoxy-phenyl)methylamino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(3-methoxy-4-phenylmethoxy-phenyl)methylamino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(4-benzyloxy-3-methoxy-phenyl)methylamino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[(3-methoxy-4-phenylmethoxyphenyl)methylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(3-methoxy-4-phenylmethoxyphenyl)methylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(4-benzoxy-3-methoxy-benzyl)amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O6S/c1-23-32(28,29)18-9-10-19(20(13-18)25(26)27)24-14-17-8-11-21(22(12-17)30-2)31-15-16-6-4-3-5-7-16/h3-13,23-24H,14-15H2,1-2H3