2-(2-oxidanylidenepyrrolidin-1-yl)ethyl-[1-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-yl]azanium

Systemtic Name: 2-(2-oxidanylidenepyrrolidin-1-yl)ethyl-[1-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-yl]azanium Openeye Name: 2-(2-oxopyrrolidin-1-yl)ethyl-[1-[3-(1H-pyrazol-5-yl)phenyl]-4-piperidyl]ammonium CAS Name: 2-(2-oxo-1-pyrrolidinyl)ethyl-[1-[3-(1H-pyrazol-5-yl)phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-(2-oxopyrrolidin-1-yl)ethyl-[1-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-yl]azanium Traditional Name: 2-(2-ketopyrrolidino)ethyl-[1-[3-(1H-pyrazol-5-yl)phenyl]-4-piperidyl]ammonium Formula: C20H28N5O+ MolecularWeight: 354.46922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC[NH2+]C2CCN(CC2)C3=CC=CC(=C3)C4=CC=NN4

Isomeric SMILES

C1CC(=O)N(C1)CC[NH2+]C2CCN(CC2)C3=CC=CC(=C3)C4=CC=NN4

InChI

InChI=1S/C20H27N5O/c26-20-5-2-11-25(20)14-10-21-17-7-12-24(13-8-17)18-4-1-3-16(15-18)19-6-9-22-23-19/h1,3-4,6,9,15,17,21H,2,5,7-8,10-14H2,(H,22,23)/p+1