2-[(2S)-1-cyclopentyl-4-[(2-fluoranyl-5-methoxy-phenyl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-[(2-fluoranyl-5-methoxy-phenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-[(2-fluoro-5-methoxy-phenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[(2-fluoro-5-methoxyphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-[(2-fluoro-5-methoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-(2-fluoro-5-methoxy-benzyl)piperazin-1-ium-2-yl]ethanol Formula: C19H30FN2O2+ MolecularWeight: 337.452103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)CN2CC[NH+](C(C2)CCO)C3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)F)CN2CC[NH+]([C@H](C2)CCO)C3CCCC3

InChI

InChI=1S/C19H29FN2O2/c1-24-18-6-7-19(20)15(12-18)13-21-9-10-22(16-4-2-3-5-16)17(14-21)8-11-23/h6-7,12,16-17,23H,2-5,8-11,13-14H2,1H3/p+1/t17-/m0/s1