N-[(1-ethylpiperidin-3-yl)methyl]-1-[4-oxidanyl-1-(3,3,3-triphenylpropanoyl)pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[(1-ethylpiperidin-3-yl)methyl]-1-[4-oxidanyl-1-(3,3,3-triphenylpropanoyl)pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[(1-ethyl-3-piperidyl)methyl]-1-[4-hydroxy-1-(3,3,3-triphenylpropanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide CAS Name: N-[(1-ethyl-3-piperidinyl)methyl]-1-[[4-hydroxy-1-(1-oxo-3,3,3-triphenylpropyl)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(1-ethylpiperidin-3-yl)methyl]-1-[4-hydroxy-1-(3,3,3-triphenylpropanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide Traditional Name: N-[(1-ethyl-3-piperidyl)methyl]-1-[4-hydroxy-1-(3,3,3-triphenylpropanoyl)prolyl]pyrrolidine-2-carboxamide Formula: C39H48N4O4 MolecularWeight: 636.82282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)CNC(=O)C2CCCN2C(=O)C3CC(CN3C(=O)CC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)O

Isomeric SMILES

CCN1CCCC(C1)CNC(=O)C2CCCN2C(=O)C3CC(CN3C(=O)CC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)O

InChI

InChI=1S/C39H48N4O4/c1-2-41-22-12-14-29(27-41)26-40-37(46)34-21-13-23-42(34)38(47)35-24-33(44)28-43(35)36(45)25-39(30-15-6-3-7-16-30,31-17-8-4-9-18-31)32-19-10-5-11-20-32/h3-11,15-20,29,33-35,44H,2,12-14,21-28H2,1H3,(H,40,46)