5-ethoxy-1-pyridin-4-yl-pentane-1,3-dione

Systemtic Name: 5-ethoxy-1-pyridin-4-yl-pentane-1,3-dione Openeye Name: 5-ethoxy-1-(4-pyridyl)pentane-1,3-dione CAS Name: 5-ethoxy-1-pyridin-4-ylpentane-1,3-dione IUPAC Name: 5-ethoxy-1-pyridin-4-ylpentane-1,3-dione Traditional Name: 5-ethoxy-1-(4-pyridyl)pentane-1,3-dione Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(=O)CC(=O)C1=CC=NC=C1

Isomeric SMILES

CCOCCC(=O)CC(=O)C1=CC=NC=C1

InChI

InChI=1S/C12H15NO3/c1-2-16-8-5-11(14)9-12(15)10-3-6-13-7-4-10/h3-4,6-7H,2,5,8-9H2,1H3