N-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazine-1-carboxamide

Systemtic Name: N-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazine-1-carboxamide Openeye Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazine-1-carboxamide CAS Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinecarboxamide IUPAC Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazine-1-carboxamide Traditional Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-4-(2-keto-2-pyrrolidino-ethyl)piperazine-1-carboxamide Formula: C33H48N4O3 MolecularWeight: 548.75922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N3CCN(CC3)CC(=O)N4CCCC4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N3CCN(CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C33H48N4O3/c1-32(2,3)26-21-24(22-27(30(26)39)33(4,5)6)13-14-25-11-7-8-12-28(25)34-31(40)37-19-17-35(18-20-37)23-29(38)36-15-9-10-16-36/h7-8,11-12,21-22,39H,9-10,13-20,23H2,1-6H3,(H,34,40)