4-[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonyl-N-(4-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonyl-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[[4-chloro-3-(2-oxo-1-pyrrolidinyl)phenyl]-oxomethyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[4-chloro-3-(2-ketopyrrolidino)benzoyl]-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C22H22ClFN4O3 MolecularWeight: 444.886483

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)F)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C22H22ClFN4O3/c23-18-8-3-15(14-19(18)28-9-1-2-20(28)29)21(30)26-10-12-27(13-11-26)22(31)25-17-6-4-16(24)5-7-17/h3-8,14H,1-2,9-13H2,(H,25,31)