methyl 1-(2,2-dimethyl-3-oxidanyl-3-pyridin-2-yl-propanoyl)cyclohexane-1-carboxylate

Systemtic Name: methyl 1-(2,2-dimethyl-3-oxidanyl-3-pyridin-2-yl-propanoyl)cyclohexane-1-carboxylate Openeye Name: methyl 1-[3-hydroxy-2,2-dimethyl-3-(2-pyridyl)propanoyl]cyclohexanecarboxylate CAS Name: 1-[3-hydroxy-2,2-dimethyl-1-oxo-3-(2-pyridinyl)propyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-hydroxy-2,2-dimethyl-3-pyridin-2-ylpropanoyl)cyclohexane-1-carboxylate Traditional Name: 1-[3-hydroxy-2,2-dimethyl-3-(2-pyridyl)propanoyl]cyclohexanecarboxylic acid methyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC=CC=N1)O)C(=O)C2(CCCCC2)C(=O)OC

Isomeric SMILES

CC(C)(C(C1=CC=CC=N1)O)C(=O)C2(CCCCC2)C(=O)OC

InChI

InChI=1S/C18H25NO4/c1-17(2,14(20)13-9-5-8-12-19-13)15(21)18(16(22)23-3)10-6-4-7-11-18/h5,8-9,12,14,20H,4,6-7,10-11H2,1-3H3