methyl (3R)-12-[(2R,5S,6S)-1,6-dimethyl-5-oxidanyl-piperidin-2-yl]-3-oxidanyl-dodecanoate

Systemtic Name: methyl (3R)-12-[(2R,5S,6S)-1,6-dimethyl-5-oxidanyl-piperidin-2-yl]-3-oxidanyl-dodecanoate Openeye Name: methyl (3R)-3-hydroxy-12-[(2R,5S,6S)-5-hydroxy-1,6-dimethyl-2-piperidyl]dodecanoate CAS Name: (3R)-3-hydroxy-12-[(2R,5S,6S)-5-hydroxy-1,6-dimethyl-2-piperidinyl]dodecanoic acid methyl ester IUPAC Name: methyl (3R)-3-hydroxy-12-[(2R,5S,6S)-5-hydroxy-1,6-dimethylpiperidin-2-yl]dodecanoate Traditional Name: (3R)-3-hydroxy-12-[(2R,5S,6S)-5-hydroxy-1,6-dimethyl-2-piperidyl]lauric acid methyl ester Formula: C20H39NO4 MolecularWeight: 357.52796

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCC(N1C)CCCCCCCCCC(CC(=O)OC)O)O

Isomeric SMILES

C[C@H]1[C@H](CC[C@H](N1C)CCCCCCCCC[C@H](CC(=O)OC)O)O

InChI

InChI=1S/C20H39NO4/c1-16-19(23)14-13-17(21(16)2)11-9-7-5-4-6-8-10-12-18(22)15-20(24)25-3/h16-19,22-23H,4-15H2,1-3H3/t16-,17+,18+,19-/m0/s1