(2S)-N-[(2-chlorophenyl)methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-[(2-chlorophenyl)methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-[(2-chlorophenyl)methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-[(2-chlorophenyl)methyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-[(2-chlorophenyl)methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(2-chlorobenzyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propionamide Formula: C16H24ClN2O+ MolecularWeight: 295.82756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C)C(=O)NCC2=CC=CC=C2Cl

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C)C(=O)NCC2=CC=CC=C2Cl

InChI

InChI=1S/C16H23ClN2O/c1-12-6-5-9-19(11-12)13(2)16(20)18-10-14-7-3-4-8-15(14)17/h3-4,7-8,12-13H,5-6,9-11H2,1-2H3,(H,18,20)/p+1/t12-,13-/m0/s1