(2S)-2-(2,3-dimethylphenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: (2S)-2-(2,3-dimethylphenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide Openeye Name: (2S)-2-(2,3-dimethylphenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide CAS Name: (2S)-2-(2,3-dimethylphenoxy)-N-(1-methyl-4-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-2-(2,3-dimethylphenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide Traditional Name: (2S)-2-(2,3-dimethylphenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propionamide Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O2/c1-12-6-5-7-16(13(12)2)21-14(3)17(20)18-15-8-10-19(4)11-9-15/h5-7,14-15H,8-11H2,1-4H3,(H,18,20)/p+1/t14-/m0/s1