N-(2-methoxyphenyl)-1-[(2R)-2-oxidanyl-2-phenyl-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-1-[(2R)-2-oxidanyl-2-phenyl-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2R)-2-hydroxy-2-phenyl-ethyl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(2R)-2-hydroxy-2-phenylethyl]-N-(2-methoxyphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2R)-2-hydroxy-2-phenylethyl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[(2R)-2-hydroxy-2-phenyl-ethyl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide Formula: C21H27N2O3+ MolecularWeight: 355.45068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CC[NH+](CC2)CC(C3=CC=CC=C3)O

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CC[NH+](CC2)C[C@@H](C3=CC=CC=C3)O

InChI

InChI=1S/C21H26N2O3/c1-26-20-10-6-5-9-18(20)22-21(25)17-11-13-23(14-12-17)15-19(24)16-7-3-2-4-8-16/h2-10,17,19,24H,11-15H2,1H3,(H,22,25)/p+1/t19-/m0/s1