N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-cyanophenoxy)ethanamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-cyanophenoxy)ethanamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-cyanophenoxy)acetamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-2-(4-cyanophenoxy)acetamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-cyanophenoxy)acetamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-2-(4-cyanophenoxy)acetamide Formula: C21H23ClN3O2+ MolecularWeight: 384.87922

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)COC2=CC=C(C=C2)C#N)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)COC2=CC=C(C=C2)C#N)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O2/c22-18-5-1-17(2-6-18)14-25-11-9-19(10-12-25)24-21(26)15-27-20-7-3-16(13-23)4-8-20/h1-8,19H,9-12,14-15H2,(H,24,26)/p+1