(2S)-2-(4-methylphenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(C)C(=O)NC2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC=C(C=C1)O[C@@H](C)C(=O)NC2CC[NH+](CC2)C

InChI

InChI=1S/C16H24N2O2/c1-12-4-6-15(7-5-12)20-13(2)16(19)17-14-8-10-18(3)11-9-14/h4-7,13-14H,8-11H2,1-3H3,(H,17,19)/p+1/t13-/m0/s1