1-(6-chloranylpyridazin-3-yl)-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[3-(2-ketopyrrolidino)benzyl]nipecotamide Formula: C21H24ClN5O2 MolecularWeight: 413.90056

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(C=C2)Cl)C(=O)NCC3=CC(=CC=C3)N4CCCC4=O

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(C=C2)Cl)C(=O)NCC3=CC(=CC=C3)N4CCCC4=O

InChI

InChI=1S/C21H24ClN5O2/c22-18-8-9-19(25-24-18)26-10-2-5-16(14-26)21(29)23-13-15-4-1-6-17(12-15)27-11-3-7-20(27)28/h1,4,6,8-9,12,16H,2-3,5,7,10-11,13-14H2,(H,23,29)