(3S)-N-(4-fluorophenyl)-1-propan-2-yl-piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-(4-fluorophenyl)-1-propan-2-yl-piperidin-1-ium-3-amine Openeye Name: (3S)-N-(4-fluorophenyl)-1-isopropyl-piperidin-1-ium-3-amine CAS Name: (3S)-N-(4-fluorophenyl)-1-propan-2-yl-3-piperidin-1-iumamine IUPAC Name: (3S)-N-(4-fluorophenyl)-1-propan-2-ylpiperidin-1-ium-3-amine Traditional Name: (4-fluorophenyl)-[(3S)-1-isopropylpiperidin-1-ium-3-yl]amine Formula: C14H22FN2+ MolecularWeight: 237.336283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCCC(C1)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)[NH+]1CCC[C@@H](C1)NC2=CC=C(C=C2)F

InChI

InChI=1S/C14H21FN2/c1-11(2)17-9-3-4-14(10-17)16-13-7-5-12(15)6-8-13/h5-8,11,14,16H,3-4,9-10H2,1-2H3/p+1/t14-/m0/s1