N-(2,4-dimethylphenyl)-2-[4-(4-fluorophenyl)carbonylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[4-(4-fluorophenyl)carbonylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(2,4-dimethylphenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-ium-1-yl]acetamide Formula: C22H26FN2O2+ MolecularWeight: 369.452443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H25FN2O2/c1-15-3-8-20(16(2)13-15)24-21(26)14-25-11-9-18(10-12-25)22(27)17-4-6-19(23)7-5-17/h3-8,13,18H,9-12,14H2,1-2H3,(H,24,26)/p+1