N-[(2S)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(2-methoxyphenoxy)ethanamide

Systemtic Name: N-[(2S)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(2-methoxyphenoxy)ethanamide Openeye Name: N-[(2S)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(2-methoxyphenoxy)acetamide CAS Name: N-[(2S)-2-(4-chlorophenyl)-2-(1-piperidin-1-iumyl)ethyl]-2-(2-methoxyphenoxy)acetamide IUPAC Name: N-[(2S)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-ylethyl]-2-(2-methoxyphenoxy)acetamide Traditional Name: N-[(2S)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(2-methoxyphenoxy)acetamide Formula: C22H28ClN2O3+ MolecularWeight: 403.92232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(=O)NCC(C2=CC=C(C=C2)Cl)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=CC=C1OCC(=O)NC[C@H](C2=CC=C(C=C2)Cl)[NH+]3CCCCC3

InChI

InChI=1S/C22H27ClN2O3/c1-27-20-7-3-4-8-21(20)28-16-22(26)24-15-19(25-13-5-2-6-14-25)17-9-11-18(23)12-10-17/h3-4,7-12,19H,2,5-6,13-16H2,1H3,(H,24,26)/p+1/t19-/m1/s1