N-[(2R)-2-oxidanylpropyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(2R)-2-oxidanylpropyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-N-[(2R)-2-hydroxypropyl]piperidin-1-ium-4-carboxamide CAS Name: N-[(2R)-2-hydroxypropyl]-1-[(4-phenylmethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(2R)-2-hydroxypropyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-benzoxybenzyl)-N-[(2R)-2-hydroxypropyl]piperidin-1-ium-4-carboxamide Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

C[C@H](CNC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C23H30N2O3/c1-18(26)15-24-23(27)21-11-13-25(14-12-21)16-19-7-9-22(10-8-19)28-17-20-5-3-2-4-6-20/h2-10,18,21,26H,11-17H2,1H3,(H,24,27)/p+1/t18-/m1/s1