N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]acetamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(3S)-3-hydroxy-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]acetamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]acetamide Formula: C15H22ClN2O3+ MolecularWeight: 313.79978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C[NH+]2CCCC(C2)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C[NH+]2CCC[C@@H](C2)O

InChI

InChI=1S/C15H21ClN2O3/c1-10-6-13(14(21-2)7-12(10)16)17-15(20)9-18-5-3-4-11(19)8-18/h6-7,11,19H,3-5,8-9H2,1-2H3,(H,17,20)/p+1/t11-/m0/s1