2-[4-(4-chlorophenyl)carbonylpiperidin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperidin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[4-(4-chlorobenzoyl)piperidin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)acetamide CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperidin-1-iumyl]-N-(2,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[4-(4-chlorobenzoyl)piperidin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)acetamide Traditional Name: 2-[4-(4-chlorobenzoyl)piperidin-1-ium-1-yl]-N-(2,5-dimethoxyphenyl)acetamide Formula: C22H26ClN2O4+ MolecularWeight: 417.90584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O4/c1-28-18-7-8-20(29-2)19(13-18)24-21(26)14-25-11-9-16(10-12-25)22(27)15-3-5-17(23)6-4-15/h3-8,13,16H,9-12,14H2,1-2H3,(H,24,26)/p+1