N-(3-chloranyl-2-methyl-phenyl)-2-[4-(4-fluorophenyl)carbonylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[4-(4-fluorophenyl)carbonylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-ium-1-yl]acetamide Formula: C21H23ClFN2O2+ MolecularWeight: 389.870923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22ClFN2O2/c1-14-18(22)3-2-4-19(14)24-20(26)13-25-11-9-16(10-12-25)21(27)15-5-7-17(23)8-6-15/h2-8,16H,9-13H2,1H3,(H,24,26)/p+1