(3S)-3-[2-(3-fluorophenyl)ethyl]-1-(1H-imidazol-5-ylmethyl)piperidin-1-ium

Systemtic Name: (3S)-3-[2-(3-fluorophenyl)ethyl]-1-(1H-imidazol-5-ylmethyl)piperidin-1-ium Openeye Name: (3S)-3-[2-(3-fluorophenyl)ethyl]-1-(1H-imidazol-5-ylmethyl)piperidin-1-ium CAS Name: (3S)-3-[2-(3-fluorophenyl)ethyl]-1-(1H-imidazol-5-ylmethyl)piperidin-1-ium IUPAC Name: (3S)-3-[2-(3-fluorophenyl)ethyl]-1-(1H-imidazol-5-ylmethyl)piperidin-1-ium Traditional Name: (3S)-3-[2-(3-fluorophenyl)ethyl]-1-(1H-imidazol-5-ylmethyl)piperidin-1-ium Formula: C17H23FN3+ MolecularWeight: 288.383023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CN=CN2)CCC3=CC(=CC=C3)F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CN=CN2)CCC3=CC(=CC=C3)F

InChI

InChI=1S/C17H22FN3/c18-16-5-1-3-14(9-16)6-7-15-4-2-8-21(11-15)12-17-10-19-13-20-17/h1,3,5,9-10,13,15H,2,4,6-8,11-12H2,(H,19,20)/p+1/t15-/m1/s1