[2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]-[(2S)-2-(hydroxymethyl)piperidin-1-yl]methanone

Systemtic Name: [2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]-[(2S)-2-(hydroxymethyl)piperidin-1-yl]methanone Openeye Name: [2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]-[(2S)-2-(hydroxymethyl)-1-piperidyl]methanone CAS Name: [2-[(1-cyclopentyl-4-piperidin-1-iumyl)oxy]-5-methoxyphenyl]-[(2S)-2-(hydroxymethyl)-1-piperidinyl]methanone IUPAC Name: [2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxyphenyl]-[(2S)-2-(hydroxymethyl)piperidin-1-yl]methanone Traditional Name: [2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]-[(2S)-2-methylolpiperidino]methanone Formula: C24H37N2O4+ MolecularWeight: 417.56158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC2CC[NH+](CC2)C3CCCC3)C(=O)N4CCCCC4CO

Isomeric SMILES

COC1=CC(=C(C=C1)OC2CC[NH+](CC2)C3CCCC3)C(=O)N4CCCC[C@H]4CO

InChI

InChI=1S/C24H36N2O4/c1-29-21-9-10-23(22(16-21)24(28)26-13-5-4-8-19(26)17-27)30-20-11-14-25(15-12-20)18-6-2-3-7-18/h9-10,16,18-20,27H,2-8,11-15,17H2,1H3/p+1/t19-/m0/s1