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

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperidin-1-ium-1-yl]-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-[4-(4-chlorobenzoyl)piperidin-1-ium-1-yl]-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperidin-1-iumyl]-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-[4-(4-chlorobenzoyl)piperidin-1-ium-1-yl]-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-[4-(4-chlorobenzoyl)piperidin-1-ium-1-yl]-N-(2,5-dimethylphenyl)acetamide Formula: C22H26ClN2O2+ MolecularWeight: 385.90704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClN2O2/c1-15-3-4-16(2)20(13-15)24-21(26)14-25-11-9-18(10-12-25)22(27)17-5-7-19(23)8-6-17/h3-8,13,18H,9-12,14H2,1-2H3,(H,24,26)/p+1