2-(4-ethylphenoxy)-1-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(4-ethylphenoxy)-1-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]ethanone Openeye Name: 2-(4-ethylphenoxy)-1-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)-1-piperidyl]ethanone CAS Name: 2-(4-ethylphenoxy)-1-[(2S)-2-[2-(1-piperidin-1-iumyl)ethyl]-1-piperidinyl]ethanone IUPAC Name: 2-(4-ethylphenoxy)-1-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]ethanone Traditional Name: 2-(4-ethylphenoxy)-1-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidino]ethanone Formula: C22H35N2O2+ MolecularWeight: 359.5255

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)N2CCCCC2CC[NH+]3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)N2CCCC[C@H]2CC[NH+]3CCCCC3

InChI

InChI=1S/C22H34N2O2/c1-2-19-9-11-21(12-10-19)26-18-22(25)24-16-7-4-8-20(24)13-17-23-14-5-3-6-15-23/h9-12,20H,2-8,13-18H2,1H3/p+1/t20-/m0/s1