1-[4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]pyrrolidin-2-one Openeye Name: 1-[4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[4-(4-chlorobenzyl)piperazin-4-ium-1-carbonyl]phenyl]-2-pyrrolidone Formula: C22H25ClN3O2+ MolecularWeight: 398.9058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H24ClN3O2/c23-19-7-3-17(4-8-19)16-24-12-14-25(15-13-24)22(28)18-5-9-20(10-6-18)26-11-1-2-21(26)27/h3-10H,1-2,11-16H2/p+1