(2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: (2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide Openeye Name: (2S)-2-(4-chloro-3-methyl-phenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide CAS Name: (2S)-2-(4-chloro-3-methylphenoxy)-N-(1-methyl-4-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-2-(4-chloro-3-methylphenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propanamide Traditional Name: (2S)-2-(4-chloro-3-methyl-phenoxy)-N-(1-methylpiperidin-1-ium-4-yl)propionamide Formula: C16H24ClN2O2+ MolecularWeight: 311.82696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23ClN2O2/c1-11-10-14(4-5-15(11)17)21-12(2)16(20)18-13-6-8-19(3)9-7-13/h4-5,10,12-13H,6-9H2,1-3H3,(H,18,20)/p+1/t12-/m0/s1