2,4-diethanoyl-5-methyl-5-oxidanyl-3-pyridin-2-yl-cyclohexan-1-one

Systemtic Name: 2,4-diethanoyl-5-methyl-5-oxidanyl-3-pyridin-2-yl-cyclohexan-1-one Openeye Name: 2,4-diacetyl-5-hydroxy-5-methyl-3-(2-pyridyl)cyclohexanone CAS Name: 2,4-diacetyl-5-hydroxy-5-methyl-3-(2-pyridinyl)-1-cyclohexanone IUPAC Name: 2,4-diacetyl-5-hydroxy-5-methyl-3-pyridin-2-ylcyclohexan-1-one Traditional Name: 2,4-diacetyl-5-hydroxy-5-methyl-3-(2-pyridyl)cyclohexanone Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(C(C(CC1=O)(C)O)C(=O)C)C2=CC=CC=N2

Isomeric SMILES

CC(=O)C1C(C(C(CC1=O)(C)O)C(=O)C)C2=CC=CC=N2

InChI

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