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

Systemtic Name: 1-[4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]pyrrolidin-2-one Openeye Name: 1-[4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]pyrrolidin-2-one CAS Name: 1-[4-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]pyrrolidin-2-one Traditional Name: 1-[4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]-2-pyrrolidone Formula: C28H30N3O2+ MolecularWeight: 440.5567

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2/c32-26-12-7-17-31(26)25-15-13-24(14-16-25)28(33)30-20-18-29(19-21-30)27(22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-6,8-11,13-16,27H,7,12,17-21H2/p+1