N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-methoxy-benzenesulfonamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-methoxy-benzenesulfonamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-methoxy-benzenesulfonamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-3-methoxybenzenesulfonamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-3-methoxybenzenesulfonamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-3-methoxy-benzenesulfonamide Formula: C21H29N3O3S MolecularWeight: 403.53826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC(=C2)OC)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC(=C2)OC)N3CCCC3

InChI

InChI=1S/C21H29N3O3S/c1-23(2)18-11-9-17(10-12-18)21(24-13-4-5-14-24)16-22-28(25,26)20-8-6-7-19(15-20)27-3/h6-12,15,21-22H,4-5,13-14,16H2,1-3H3