(3S,4S,5R,6S)-6-(hydroxymethyl)-5-oxidanyl-3-propyl-4-tridecyl-piperidin-2-one

Systemtic Name: (3S,4S,5R,6S)-6-(hydroxymethyl)-5-oxidanyl-3-propyl-4-tridecyl-piperidin-2-one Openeye Name: (3S,4S,5R,6S)-5-hydroxy-6-(hydroxymethyl)-3-propyl-4-tridecyl-piperidin-2-one CAS Name: (3S,4S,5R,6S)-5-hydroxy-6-(hydroxymethyl)-3-propyl-4-tridecyl-2-piperidinone IUPAC Name: (3S,4S,5R,6S)-5-hydroxy-6-(hydroxymethyl)-3-propyl-4-tridecylpiperidin-2-one Traditional Name: (3S,4S,5R,6S)-5-hydroxy-6-methylol-3-propyl-4-tridecyl-2-piperidone Formula: C22H43NO3 MolecularWeight: 369.58172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1C(C(=O)NC(C1O)CO)CCC

Isomeric SMILES

CCCCCCCCCCCCC[C@H]1[C@@H](C(=O)N[C@H]([C@@H]1O)CO)CCC

InChI

InChI=1S/C22H43NO3/c1-3-5-6-7-8-9-10-11-12-13-14-16-18-19(15-4-2)22(26)23-20(17-24)21(18)25/h18-21,24-25H,3-17H2,1-2H3,(H,23,26)/t18-,19-,20-,21+/m0/s1