N-[1-[(4-cyanophenyl)methyl]-4-(4-methoxyphenyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: N-[1-[(4-cyanophenyl)methyl]-4-(4-methoxyphenyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-[1-[(4-cyanophenyl)methyl]-4-(4-methoxyphenyl)piperidin-1-ium-4-yl]acetamide CAS Name: N-[1-[(4-cyanophenyl)methyl]-4-(4-methoxyphenyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-[1-[(4-cyanophenyl)methyl]-4-(4-methoxyphenyl)piperidin-1-ium-4-yl]acetamide Traditional Name: N-[1-(4-cyanobenzyl)-4-(4-methoxyphenyl)piperidin-1-ium-4-yl]acetamide Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CC[NH+](CC1)CC2=CC=C(C=C2)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)NC1(CC[NH+](CC1)CC2=CC=C(C=C2)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N3O2/c1-17(26)24-22(20-7-9-21(27-2)10-8-20)11-13-25(14-12-22)16-19-5-3-18(15-23)4-6-19/h3-10H,11-14,16H2,1-2H3,(H,24,26)/p+1