1-[(1R,2S,6S)-3-ethanoyl-6-methyl-4,6-bis(oxidanyl)-2-pyridin-3-yl-cyclohex-3-en-1-yl]ethanone

Systemtic Name: 1-[(1R,2S,6S)-3-ethanoyl-6-methyl-4,6-bis(oxidanyl)-2-pyridin-3-yl-cyclohex-3-en-1-yl]ethanone Openeye Name: 1-[(1R,2S,6S)-3-acetyl-4,6-dihydroxy-6-methyl-2-(3-pyridyl)cyclohex-3-en-1-yl]ethanone CAS Name: 1-[(1R,2S,6S)-3-acetyl-4,6-dihydroxy-6-methyl-2-(3-pyridinyl)-1-cyclohex-3-enyl]ethanone IUPAC Name: 1-[(1R,2S,6S)-3-acetyl-4,6-dihydroxy-6-methyl-2-pyridin-3-ylcyclohex-3-en-1-yl]ethanone Traditional Name: 1-[(1R,2S,6S)-3-acetyl-4,6-dihydroxy-6-methyl-2-(3-pyridyl)cyclohex-3-en-1-yl]ethanone Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(C(=C(CC1(C)O)O)C(=O)C)C2=CN=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO4/c1-9(18)13-12(20)7-16(3,21)15(10(2)19)14(13)11-5-4-6-17-8-11/h4-6,8,14-15,20-21H,7H2,1-3H3/t14-,15+,16-/m0/s1