1-[4-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]ethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetyl]phenyl]-2-pyrrolidone Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)C[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)C[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H23N5O2/c26-18(16-4-6-17(7-5-16)25-10-1-3-19(25)27)15-23-11-13-24(14-12-23)20-21-8-2-9-22-20/h2,4-9H,1,3,10-15H2/p+1