(3S)-1-[(2-fluorophenyl)methyl]-N-(oxan-4-yl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-[(2-fluorophenyl)methyl]-N-(oxan-4-yl)piperidin-1-ium-3-amine Openeye Name: (3S)-1-[(2-fluorophenyl)methyl]-N-tetrahydropyran-4-yl-piperidin-1-ium-3-amine CAS Name: (3S)-1-[(2-fluorophenyl)methyl]-N-(4-oxanyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-1-[(2-fluorophenyl)methyl]-N-(oxan-4-yl)piperidin-1-ium-3-amine Traditional Name: [(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-tetrahydropyran-4-yl-amine Formula: C17H26FN2O+ MolecularWeight: 293.399543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=C2F)NC3CCOCC3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=C2F)NC3CCOCC3

InChI

InChI=1S/C17H25FN2O/c18-17-6-2-1-4-14(17)12-20-9-3-5-16(13-20)19-15-7-10-21-11-8-15/h1-2,4,6,15-16,19H,3,5,7-13H2/p+1/t16-/m0/s1