4-butyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-butyl-benzenesulfonamide CAS Name: 4-butyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-butylbenzenesulfonamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-butyl-benzenesulfonamide Formula: C21H28N2O2S MolecularWeight: 372.52422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(C2)CC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O2S/c1-2-3-7-18-10-12-21(13-11-18)26(24,25)22-20-14-15-23(17-20)16-19-8-5-4-6-9-19/h4-6,8-13,20,22H,2-3,7,14-17H2,1H3