2-[4-(cyclopentylmethyl)piperazin-4-ium-1-yl]-5-fluoranyl-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(cyclopentylmethyl)piperazin-4-ium-1-yl]-5-fluoranyl-1H-pyrimidin-6-one Openeye Name: 2-[4-(cyclopentylmethyl)piperazin-4-ium-1-yl]-5-fluoro-1H-pyrimidin-6-one CAS Name: 2-[4-(cyclopentylmethyl)-1-piperazin-4-iumyl]-5-fluoro-1H-pyrimidin-6-one IUPAC Name: 2-[4-(cyclopentylmethyl)piperazin-4-ium-1-yl]-5-fluoro-1H-pyrimidin-6-one Traditional Name: 2-[4-(cyclopentylmethyl)piperazin-4-ium-1-yl]-5-fluoro-1H-pyrimidin-6-one Formula: C14H22FN4O+ MolecularWeight: 281.349083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C[NH+]2CCN(CC2)C3=NC=C(C(=O)N3)F

Isomeric SMILES

C1CCC(C1)C[NH+]2CCN(CC2)C3=NC=C(C(=O)N3)F

InChI

InChI=1S/C14H21FN4O/c15-12-9-16-14(17-13(12)20)19-7-5-18(6-8-19)10-11-3-1-2-4-11/h9,11H,1-8,10H2,(H,16,17,20)/p+1