N-[(2R)-3-ethoxy-2-oxidanyl-propyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[(2R)-3-ethoxy-2-oxidanyl-propyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[(2R)-3-ethoxy-2-hydroxy-propyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[(2R)-3-ethoxy-2-hydroxypropyl]-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[(2R)-3-ethoxy-2-hydroxypropyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[(2R)-3-ethoxy-2-hydroxy-propyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C25H35N2O4+ MolecularWeight: 427.5564

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CNC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CCC3=CC=CC=C3)O

Isomeric SMILES

CCOC[C@@H](CNC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CCC3=CC=CC=C3)O

InChI

InChI=1S/C25H34N2O4/c1-2-30-19-22(28)18-26-25(29)21-8-10-23(11-9-21)31-24-13-16-27(17-14-24)15-12-20-6-4-3-5-7-20/h3-11,22,24,28H,2,12-19H2,1H3,(H,26,29)/p+1/t22-/m1/s1