(3R,4R,5S)-2-(hydroxymethyl)-4-methoxy-1-(4-phenylbutyl)piperidine-3,5-diol

Systemtic Name: (3R,4R,5S)-2-(hydroxymethyl)-4-methoxy-1-(4-phenylbutyl)piperidine-3,5-diol Openeye Name: (3R,4R,5S)-2-(hydroxymethyl)-4-methoxy-1-(4-phenylbutyl)piperidine-3,5-diol CAS Name: (3R,4R,5S)-2-(hydroxymethyl)-4-methoxy-1-(4-phenylbutyl)piperidine-3,5-diol IUPAC Name: (3R,4R,5S)-2-(hydroxymethyl)-4-methoxy-1-(4-phenylbutyl)piperidine-3,5-diol Traditional Name: (3R,4R,5S)-4-methoxy-2-methylol-1-(4-phenylbutyl)piperidine-3,5-diol Formula: C17H27NO4 MolecularWeight: 309.40058

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(CN(C(C1O)CO)CCCCC2=CC=CC=C2)O

Isomeric SMILES

CO[C@@H]1[C@H](CN(C([C@H]1O)CO)CCCCC2=CC=CC=C2)O

InChI

InChI=1S/C17H27NO4/c1-22-17-15(20)11-18(14(12-19)16(17)21)10-6-5-9-13-7-3-2-4-8-13/h2-4,7-8,14-17,19-21H,5-6,9-12H2,1H3/t14?,15-,16+,17+/m0/s1