(3S)-3-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-1-[(2-fluorophenyl)methyl]-3-oxidanyl-piperidin-2-one

Systemtic Name: (3S)-3-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-1-[(2-fluorophenyl)methyl]-3-oxidanyl-piperidin-2-one Openeye Name: (3S)-3-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-1-[(2-fluorophenyl)methyl]-3-hydroxy-piperidin-2-one CAS Name: (3S)-3-[(4-cyclopentyl-1-piperazin-4-iumyl)methyl]-1-[(2-fluorophenyl)methyl]-3-hydroxy-2-piperidinone IUPAC Name: (3S)-3-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-1-[(2-fluorophenyl)methyl]-3-hydroxypiperidin-2-one Traditional Name: (3S)-3-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-1-(2-fluorobenzyl)-3-hydroxy-2-piperidone Formula: C22H33FN3O2+ MolecularWeight: 390.514723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2)CC3(CCCN(C3=O)CC4=CC=CC=C4F)O

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(CC2)C[C@]3(CCCN(C3=O)CC4=CC=CC=C4F)O

InChI

InChI=1S/C22H32FN3O2/c23-20-9-4-1-6-18(20)16-26-11-5-10-22(28,21(26)27)17-24-12-14-25(15-13-24)19-7-2-3-8-19/h1,4,6,9,19,28H,2-3,5,7-8,10-17H2/p+1/t22-/m0/s1