1-[(3R)-3-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]ethanone

Systemtic Name: 1-[(3R)-3-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]ethanone Openeye Name: 1-[(3R)-3-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-4-ium-1-carbonyl]-1-piperidyl]ethanone CAS Name: 1-[(3R)-3-[[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-1-piperidinyl]ethanone IUPAC Name: 1-[(3R)-3-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]piperidin-1-yl]ethanone Traditional Name: 1-[(3R)-3-[4-(5-fluoro-2-methoxy-benzyl)piperazin-4-ium-1-carbonyl]piperidino]ethanone Formula: C20H29FN3O3+ MolecularWeight: 378.460963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC(C1)C(=O)N2CC[NH+](CC2)CC3=C(C=CC(=C3)F)OC

Isomeric SMILES

CC(=O)N1CCC[C@H](C1)C(=O)N2CC[NH+](CC2)CC3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C20H28FN3O3/c1-15(25)24-7-3-4-16(14-24)20(26)23-10-8-22(9-11-23)13-17-12-18(21)5-6-19(17)27-2/h5-6,12,16H,3-4,7-11,13-14H2,1-2H3/p+1/t16-/m1/s1