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

Systemtic Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-[(3R)-3-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-[(3R)-3-methylpiperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-[(3R)-3-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-[(4-methoxyphenyl)methyl]-2-[(3R)-3-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]-N-p-anisyl-propionamide Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C)C(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)[C@@H](C)C(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H26N2O2/c1-13-5-4-10-19(12-13)14(2)17(20)18-11-15-6-8-16(21-3)9-7-15/h6-9,13-14H,4-5,10-12H2,1-3H3,(H,18,20)/p+1/t13-,14+/m1/s1