2-[(3R,4R)-3-oxidanyl-4-phenyl-piperidin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(3R,4R)-3-oxidanyl-4-phenyl-piperidin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[(3R,4R)-3-hydroxy-4-phenyl-piperidin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[(3R,4R)-3-hydroxy-4-phenyl-1-piperidin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[(3R,4R)-3-hydroxy-4-phenylpiperidin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[(3R,4R)-3-hydroxy-4-phenyl-piperidin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCC(C(C1)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CC[C@@H]([C@H](C1)O)C2=CC=CC=C2

InChI

InChI=1S/C16H24N2O2/c1-12(2)17-16(20)11-18-9-8-14(15(19)10-18)13-6-4-3-5-7-13/h3-7,12,14-15,19H,8-11H2,1-2H3,(H,17,20)/p+1/t14-,15+/m1/s1