4-tert-butyl-N-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[3-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[3-[(2-ketopyrrolidino)methyl]phenyl]benzenesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CN3CCCC3=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CN3CCCC3=O

InChI

InChI=1S/C21H26N2O3S/c1-21(2,3)17-9-11-19(12-10-17)27(25,26)22-18-7-4-6-16(14-18)15-23-13-5-8-20(23)24/h4,6-7,9-12,14,22H,5,8,13,15H2,1-3H3