N-[(2R)-3-methoxy-2-oxidanyl-propyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-[(2R)-3-methoxy-2-oxidanyl-propyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-[(2R)-2-hydroxy-3-methoxy-propyl]-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-[(2R)-2-hydroxy-3-methoxypropyl]-4-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-[(2R)-2-hydroxy-3-methoxypropyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-[(2R)-2-hydroxy-3-methoxy-propyl]-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C22H30N3O4+ MolecularWeight: 400.4913

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CNC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CC3=CC=CC=N3)O

Isomeric SMILES

COC[C@@H](CNC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CC3=CC=CC=N3)O

InChI

InChI=1S/C22H29N3O4/c1-28-16-19(26)14-24-22(27)17-5-7-20(8-6-17)29-21-9-12-25(13-10-21)15-18-4-2-3-11-23-18/h2-8,11,19,21,26H,9-10,12-16H2,1H3,(H,24,27)/p+1/t19-/m1/s1