N-(4-fluorophenyl)-2-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-(4-fluorophenyl)acetamide CAS Name: N-(4-fluorophenyl)-2-[[1-oxo-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethyl]amino]acetamide IUPAC Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-(4-fluorophenyl)acetamide Formula: C22H27FN3O2+ MolecularWeight: 384.467083

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O2/c23-19-6-8-20(9-7-19)25-21(27)15-24-22(28)16-26-12-10-18(11-13-26)14-17-4-2-1-3-5-17/h1-9,18H,10-16H2,(H,24,28)(H,25,27)/p+1