2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(2-furylmethyl)acetamide CAS Name: 2-[4-acetamido-4-(4-fluorophenyl)-1-piperidin-1-iumyl]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[4-acetamido-4-(4-fluorophenyl)piperidin-1-ium-1-yl]-N-(2-furfuryl)acetamide Formula: C20H25FN3O3+ MolecularWeight: 374.429203

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CC[NH+](CC1)CC(=O)NCC2=CC=CO2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1(CC[NH+](CC1)CC(=O)NCC2=CC=CO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H24FN3O3/c1-15(25)23-20(16-4-6-17(21)7-5-16)8-10-24(11-9-20)14-19(26)22-13-18-3-2-12-27-18/h2-7,12H,8-11,13-14H2,1H3,(H,22,26)(H,23,25)/p+1