3-[5-(2-fluorophenyl)furan-2-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: 3-[5-(2-fluorophenyl)furan-2-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[5-(2-fluorophenyl)-2-furyl]propanamide CAS Name: 3-[5-(2-fluorophenyl)-2-furanyl]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[5-(2-fluorophenyl)-2-furyl]propionamide Formula: C25H28FN2O2+ MolecularWeight: 407.500423

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CCC2=CC=C(O2)C3=CC=CC=C3F)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CCC2=CC=C(O2)C3=CC=CC=C3F)CC4=CC=CC=C4

InChI

InChI=1S/C25H27FN2O2/c26-23-9-5-4-8-22(23)24-12-10-21(30-24)11-13-25(29)27-20-14-16-28(17-15-20)18-19-6-2-1-3-7-19/h1-10,12,20H,11,13-18H2,(H,27,29)/p+1