1-(4-methoxypyridin-3-yl)-2-methyl-5-phenyl-pentane-1,3,5-trione

Systemtic Name: 1-(4-methoxypyridin-3-yl)-2-methyl-5-phenyl-pentane-1,3,5-trione Openeye Name: 1-(4-methoxy-3-pyridyl)-2-methyl-5-phenyl-pentane-1,3,5-trione CAS Name: 1-(4-methoxy-3-pyridinyl)-2-methyl-5-phenylpentane-1,3,5-trione IUPAC Name: 1-(4-methoxypyridin-3-yl)-2-methyl-5-phenylpentane-1,3,5-trione Traditional Name: 1-(4-methoxy-3-pyridyl)-2-methyl-5-phenyl-pentane-1,3,5-trione Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO4/c1-12(18(22)14-11-19-9-8-17(14)23-2)15(20)10-16(21)13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3