(3S)-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonyl-1-phenyl-pyrrolidin-2-one

Systemtic Name: (3S)-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonyl-1-phenyl-pyrrolidin-2-one Openeye Name: (3S)-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]-1-phenyl-pyrrolidin-2-one CAS Name: (3S)-3-[[4-[(3-fluorophenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-1-phenyl-2-pyrrolidinone IUPAC Name: (3S)-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]-1-phenylpyrrolidin-2-one Traditional Name: (3S)-3-[4-(3-fluorobenzyl)piperazin-4-ium-1-carbonyl]-1-phenyl-2-pyrrolidone Formula: C22H25FN3O2+ MolecularWeight: 382.451203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(=O)[C@@H]1C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C22H24FN3O2/c23-18-6-4-5-17(15-18)16-24-11-13-25(14-12-24)21(27)20-9-10-26(22(20)28)19-7-2-1-3-8-19/h1-8,15,20H,9-14,16H2/p+1/t20-/m0/s1