(3R)-N-[2-(2-fluorophenyl)ethyl]-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-N-[2-(2-fluorophenyl)ethyl]-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3R)-N-[2-(2-fluorophenyl)ethyl]-1-(1-isopropylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide CAS Name: (3R)-N-[2-(2-fluorophenyl)ethyl]-1-(1-propan-2-yl-4-piperidin-1-iumyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-N-[2-(2-fluorophenyl)ethyl]-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3R)-N-[2-(2-fluorophenyl)ethyl]-1-(1-isopropylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Formula: C22H36FN3O+2 MolecularWeight: 377.539143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCCC3=CC=CC=C3F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH+]2CCC[C@H](C2)C(=O)NCCC3=CC=CC=C3F

InChI

InChI=1S/C22H34FN3O/c1-17(2)25-14-10-20(11-15-25)26-13-5-7-19(16-26)22(27)24-12-9-18-6-3-4-8-21(18)23/h3-4,6,8,17,19-20H,5,7,9-16H2,1-2H3,(H,24,27)/p+2/t19-/m1/s1