1-[4-[2-oxidanylidene-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-oxidanylidene-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-oxo-2-[4-(4-pyridin-1-iumyl)-1-piperazinyl]ethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-keto-2-(4-pyridin-1-ium-4-ylpiperazino)ethyl]phenyl]-2-pyrrolidone Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CC(=O)N3CCN(CC3)C4=CC=[NH+]C=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CC(=O)N3CCN(CC3)C4=CC=[NH+]C=C4

InChI

InChI=1S/C21H24N4O2/c26-20-2-1-11-25(20)19-5-3-17(4-6-19)16-21(27)24-14-12-23(13-15-24)18-7-9-22-10-8-18/h3-10H,1-2,11-16H2/p+1