N-(2-chlorophenyl)-3-[1-[(4-fluoranyl-3-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-(2-chlorophenyl)-3-[1-[(4-fluoranyl-3-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2-chlorophenyl)-3-[1-[(4-fluoro-3-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-(2-chlorophenyl)-3-[1-[(4-fluoro-3-methoxyphenyl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[1-[(4-fluoro-3-methoxyphenyl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2-chlorophenyl)-3-[1-(4-fluoro-3-methoxy-benzyl)piperidin-1-ium-4-yl]propionamide Formula: C22H27ClFN2O2+ MolecularWeight: 405.913383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC=CC=C3Cl)F

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC=CC=C3Cl)F

InChI

InChI=1S/C22H26ClFN2O2/c1-28-21-14-17(6-8-19(21)24)15-26-12-10-16(11-13-26)7-9-22(27)25-20-5-3-2-4-18(20)23/h2-6,8,14,16H,7,9-13,15H2,1H3,(H,25,27)/p+1