12-[(2R,5S,6S)-6-methyl-5-oxidanyl-1-(phenylmethyl)piperidin-2-yl]dodecan-2-one

Systemtic Name: 12-[(2R,5S,6S)-6-methyl-5-oxidanyl-1-(phenylmethyl)piperidin-2-yl]dodecan-2-one Openeye Name: 12-[(2R,5S,6S)-1-benzyl-5-hydroxy-6-methyl-2-piperidyl]dodecan-2-one CAS Name: 12-[(2R,5S,6S)-5-hydroxy-6-methyl-1-(phenylmethyl)-2-piperidinyl]-2-dodecanone IUPAC Name: 12-[(2R,5S,6S)-1-benzyl-5-hydroxy-6-methylpiperidin-2-yl]dodecan-2-one Traditional Name: 12-[(2R,5S,6S)-1-benzyl-5-hydroxy-6-methyl-2-piperidyl]dodecan-2-one Formula: C25H41NO2 MolecularWeight: 387.59854

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCC(N1CC2=CC=CC=C2)CCCCCCCCCCC(=O)C)O

Isomeric SMILES

C[C@H]1[C@H](CC[C@H](N1CC2=CC=CC=C2)CCCCCCCCCCC(=O)C)O

InChI

InChI=1S/C25H41NO2/c1-21(27)14-10-7-5-3-4-6-8-13-17-24-18-19-25(28)22(2)26(24)20-23-15-11-9-12-16-23/h9,11-12,15-16,22,24-25,28H,3-8,10,13-14,17-20H2,1-2H3/t22-,24+,25-/m0/s1