N,N-diethyl-3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N,N-diethyl-3-[2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[[2-(4-methoxyphenyl)-1-pyrrolidinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]benzenesulfonamide Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCC2C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O4S/c1-4-23(5-2)29(26,27)20-9-6-8-18(16-20)22(25)24-15-7-10-21(24)17-11-13-19(28-3)14-12-17/h6,8-9,11-14,16,21H,4-5,7,10,15H2,1-3H3