N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-homoveratryl-3-pyrrolidinosulfonyl-benzenesulfonamide Formula: C20H26N2O6S2 MolecularWeight: 454.56024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C20H26N2O6S2/c1-27-19-9-8-16(14-20(19)28-2)10-11-21-29(23,24)17-6-5-7-18(15-17)30(25,26)22-12-3-4-13-22/h5-9,14-15,21H,3-4,10-13H2,1-2H3