(3S)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(4-chloro-2-methoxy-5-methyl-phenyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(4-chloro-2-methoxy-5-methylphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(4-chloro-2-methoxy-5-methylphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(4-chloro-2-methoxy-5-methyl-phenyl)piperidin-1-ium-3-carboxamide Formula: C14H20ClN2O2+ MolecularWeight: 283.7738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2CCC[NH2+]C2

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C14H19ClN2O2/c1-9-6-12(13(19-2)7-11(9)15)17-14(18)10-4-3-5-16-8-10/h6-7,10,16H,3-5,8H2,1-2H3,(H,17,18)/p+1/t10-/m0/s1