1-cyclopentyl-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonyl-5-piperidin-1-ylcarbonyl-pyridin-4-one

Systemtic Name: 1-cyclopentyl-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]carbonyl-5-piperidin-1-ylcarbonyl-pyridin-4-one Openeye Name: 1-cyclopentyl-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]-5-(piperidine-1-carbonyl)pyridin-4-one CAS Name: 1-cyclopentyl-3-[[4-[(3-fluorophenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-5-[oxo(1-piperidinyl)methyl]-4-pyridinone IUPAC Name: 1-cyclopentyl-3-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-carbonyl]-5-(piperidine-1-carbonyl)pyridin-4-one Traditional Name: 1-cyclopentyl-3-[4-(3-fluorobenzyl)piperazin-4-ium-1-carbonyl]-5-(piperidine-1-carbonyl)-4-pyridone Formula: C28H36FN4O3+ MolecularWeight: 495.608843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)N3CC[NH+](CC3)CC4=CC(=CC=C4)F)C5CCCC5

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)N3CC[NH+](CC3)CC4=CC(=CC=C4)F)C5CCCC5

InChI

InChI=1S/C28H35FN4O3/c29-22-8-6-7-21(17-22)18-30-13-15-32(16-14-30)28(36)25-20-33(23-9-2-3-10-23)19-24(26(25)34)27(35)31-11-4-1-5-12-31/h6-8,17,19-20,23H,1-5,9-16,18H2/p+1