(2S)-N-(4-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-(4-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-(4-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-(4-methoxyphenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(4-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(4-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propionamide Formula: C16H25N2O2+ MolecularWeight: 277.3819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C)C(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C)C(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H24N2O2/c1-12-5-4-10-18(11-12)13(2)16(19)17-14-6-8-15(20-3)9-7-14/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,17,19)/p+1/t12-,13-/m0/s1