1-phenyl-3-pyridin-3-yl-heptane-1,4-dione

Systemtic Name: 1-phenyl-3-pyridin-3-yl-heptane-1,4-dione Openeye Name: 1-phenyl-3-(3-pyridyl)heptane-1,4-dione CAS Name: 1-phenyl-3-(3-pyridinyl)heptane-1,4-dione IUPAC Name: 1-phenyl-3-pyridin-3-ylheptane-1,4-dione Traditional Name: 1-phenyl-3-(3-pyridyl)heptane-1,4-dione Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO2/c1-2-7-17(20)16(15-10-6-11-19-13-15)12-18(21)14-8-4-3-5-9-14/h3-6,8-11,13,16H,2,7,12H2,1H3