1-[(3S)-3-(hydroxymethyl)-3-(2-phenoxyethyl)piperidin-1-yl]-2-(4-methoxyphenoxy)ethanone

Systemtic Name: 1-[(3S)-3-(hydroxymethyl)-3-(2-phenoxyethyl)piperidin-1-yl]-2-(4-methoxyphenoxy)ethanone Openeye Name: 1-[(3S)-3-(hydroxymethyl)-3-(2-phenoxyethyl)-1-piperidyl]-2-(4-methoxyphenoxy)ethanone CAS Name: 1-[(3S)-3-(hydroxymethyl)-3-(2-phenoxyethyl)-1-piperidinyl]-2-(4-methoxyphenoxy)ethanone IUPAC Name: 1-[(3S)-3-(hydroxymethyl)-3-(2-phenoxyethyl)piperidin-1-yl]-2-(4-methoxyphenoxy)ethanone Traditional Name: 2-(4-methoxyphenoxy)-1-[(3S)-3-methylol-3-(2-phenoxyethyl)piperidino]ethanone Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)N2CCCC(C2)(CCOC3=CC=CC=C3)CO

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)N2CCC[C@@](C2)(CCOC3=CC=CC=C3)CO

InChI

InChI=1S/C23H29NO5/c1-27-19-8-10-21(11-9-19)29-16-22(26)24-14-5-12-23(17-24,18-25)13-15-28-20-6-3-2-4-7-20/h2-4,6-11,25H,5,12-18H2,1H3/t23-/m0/s1