2-(4-methoxypyridin-2-yl)-5-methyl-5-propan-2-yl-cyclohexane-1,3-dione

Systemtic Name: 2-(4-methoxypyridin-2-yl)-5-methyl-5-propan-2-yl-cyclohexane-1,3-dione Openeye Name: 5-isopropyl-2-(4-methoxy-2-pyridyl)-5-methyl-cyclohexane-1,3-dione CAS Name: 2-(4-methoxy-2-pyridinyl)-5-methyl-5-propan-2-ylcyclohexane-1,3-dione IUPAC Name: 2-(4-methoxypyridin-2-yl)-5-methyl-5-propan-2-ylcyclohexane-1,3-dione Traditional Name: 5-isopropyl-2-(4-methoxy-2-pyridyl)-5-methyl-cyclohexane-1,3-quinone Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC(=O)C(C(=O)C1)C2=NC=CC(=C2)OC)C

Isomeric SMILES

CC(C)C1(CC(=O)C(C(=O)C1)C2=NC=CC(=C2)OC)C

InChI

InChI=1S/C16H21NO3/c1-10(2)16(3)8-13(18)15(14(19)9-16)12-7-11(20-4)5-6-17-12/h5-7,10,15H,8-9H2,1-4H3