N-[2-(2,5-dimethoxyphenyl)ethyl]-3-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-3-(phenylsulfonyl)benzenesulfonamide Openeye Name: 3-(benzenesulfonyl)-N-[2-(2,5-dimethoxyphenyl)ethyl]benzenesulfonamide CAS Name: 3-(benzenesulfonyl)-N-[2-(2,5-dimethoxyphenyl)ethyl]benzenesulfonamide IUPAC Name: 3-(benzenesulfonyl)-N-[2-(2,5-dimethoxyphenyl)ethyl]benzenesulfonamide Traditional Name: 3-besyl-N-[2-(2,5-dimethoxyphenyl)ethyl]benzenesulfonamide Formula: C22H23NO6S2 MolecularWeight: 461.55112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCNS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCNS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23NO6S2/c1-28-18-11-12-22(29-2)17(15-18)13-14-23-31(26,27)21-10-6-9-20(16-21)30(24,25)19-7-4-3-5-8-19/h3-12,15-16,23H,13-14H2,1-2H3