2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-N-[(2S)-2-oxidanylbutyl]benzamide

Systemtic Name: 2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-N-[(2S)-2-oxidanylbutyl]benzamide Openeye Name: 2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-[(2S)-2-hydroxybutyl]-5-methoxy-benzamide CAS Name: 2-[(1-cyclopentyl-4-piperidin-1-iumyl)oxy]-N-[(2S)-2-hydroxybutyl]-5-methoxybenzamide IUPAC Name: 2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-[(2S)-2-hydroxybutyl]-5-methoxybenzamide Traditional Name: 2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-[(2S)-2-hydroxybutyl]-5-methoxy-benzamide Formula: C22H35N2O4+ MolecularWeight: 391.5243

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=C(C=CC(=C1)OC)OC2CC[NH+](CC2)C3CCCC3)O

Isomeric SMILES

CC[C@@H](CNC(=O)C1=C(C=CC(=C1)OC)OC2CC[NH+](CC2)C3CCCC3)O

InChI

InChI=1S/C22H34N2O4/c1-3-17(25)15-23-22(26)20-14-19(27-2)8-9-21(20)28-18-10-12-24(13-11-18)16-6-4-5-7-16/h8-9,14,16-18,25H,3-7,10-13,15H2,1-2H3,(H,23,26)/p+1/t17-/m0/s1