methyl (2S,3S,6S)-3-ethenyl-6-(hydroxymethyl)-2-(2-oxidanylidenepropyl)piperidine-1-carboxylate

Systemtic Name: methyl (2S,3S,6S)-3-ethenyl-6-(hydroxymethyl)-2-(2-oxidanylidenepropyl)piperidine-1-carboxylate Openeye Name: methyl (2S,3S,6S)-2-acetonyl-6-(hydroxymethyl)-3-vinyl-piperidine-1-carboxylate CAS Name: (2S,3S,6S)-3-ethenyl-6-(hydroxymethyl)-2-(2-oxopropyl)-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,6S)-3-ethenyl-6-(hydroxymethyl)-2-(2-oxopropyl)piperidine-1-carboxylate Traditional Name: (2S,3S,6S)-2-acetonyl-6-methylol-3-vinyl-piperidine-1-carboxylic acid methyl ester Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1C(CCC(N1C(=O)OC)CO)C=C

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO4/c1-4-10-5-6-11(8-15)14(13(17)18-3)12(10)7-9(2)16/h4,10-12,15H,1,5-8H2,2-3H3/t10-,11+,12+/m1/s1