1-[2-chloranyl-5-(4-pyridin-1-ium-4-ylpiperazin-1-yl)carbonyl-phenyl]pyrrolidin-2-one

Systemtic Name: 1-[2-chloranyl-5-(4-pyridin-1-ium-4-ylpiperazin-1-yl)carbonyl-phenyl]pyrrolidin-2-one Openeye Name: 1-[2-chloro-5-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)phenyl]pyrrolidin-2-one CAS Name: 1-[2-chloro-5-[oxo-[4-(4-pyridin-1-iumyl)-1-piperazinyl]methyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[2-chloro-5-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)phenyl]pyrrolidin-2-one Traditional Name: 1-[2-chloro-5-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)phenyl]-2-pyrrolidone Formula: C20H22ClN4O2+ MolecularWeight: 385.86728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O2/c21-17-4-3-15(14-18(17)25-9-1-2-19(25)26)20(27)24-12-10-23(11-13-24)16-5-7-22-8-6-16/h3-8,14H,1-2,9-13H2/p+1