1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(5-chloro-2-hydroxy-phenyl)methyl]-N-isopropyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(5-chloro-2-hydroxyphenyl)methyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(5-chloro-2-hydroxyphenyl)methyl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-(5-chloro-2-hydroxy-benzyl)-N-isopropyl-piperidin-1-ium-4-carboxamide Formula: C16H24ClN2O2+ MolecularWeight: 311.82696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)CC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)CC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C16H23ClN2O2/c1-11(2)18-16(21)12-5-7-19(8-6-12)10-13-9-14(17)3-4-15(13)20/h3-4,9,11-12,20H,5-8,10H2,1-2H3,(H,18,21)/p+1