methyl-[1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]piperidin-4-yl]-(pyrazin-2-ylmethyl)azanium

Systemtic Name: methyl-[1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]piperidin-4-yl]-(pyrazin-2-ylmethyl)azanium Openeye Name: methyl-[1-[4-(2-oxopyrrolidin-1-yl)phenyl]-4-piperidyl]-(pyrazin-2-ylmethyl)ammonium CAS Name: methyl-[1-[4-(2-oxo-1-pyrrolidinyl)phenyl]-4-piperidinyl]-(2-pyrazinylmethyl)ammonium IUPAC Name: methyl-[1-[4-(2-oxopyrrolidin-1-yl)phenyl]piperidin-4-yl]-(pyrazin-2-ylmethyl)azanium Traditional Name: [1-[4-(2-ketopyrrolidino)phenyl]-4-piperidyl]-methyl-(pyrazin-2-ylmethyl)ammonium Formula: C21H28N5O+ MolecularWeight: 366.47992

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC=CN=C1)C2CCN(CC2)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C[NH+](CC1=NC=CN=C1)C2CCN(CC2)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C21H27N5O/c1-24(16-17-15-22-10-11-23-17)18-8-13-25(14-9-18)19-4-6-20(7-5-19)26-12-2-3-21(26)27/h4-7,10-11,15,18H,2-3,8-9,12-14,16H2,1H3/p+1