6-[(E)-2-(furan-2-yl)ethenyl]-5-hexyl-2-methyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(furan-2-yl)ethenyl]-5-hexyl-2-methyl-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(2-furyl)vinyl]-5-hexyl-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(2-furanyl)ethenyl]-5-hexyl-2-methyl-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(furan-2-yl)ethenyl]-5-hexyl-2-methyl-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(2-furyl)vinyl]-5-hexyl-2-methyl-1H-pyrimidin-4-one Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(NC(=NC1=O)C)C=CC2=CC=CO2

Isomeric SMILES

CCCCCCC1=C(NC(=NC1=O)C)/C=C/C2=CC=CO2

InChI

InChI=1S/C17H22N2O2/c1-3-4-5-6-9-15-16(18-13(2)19-17(15)20)11-10-14-8-7-12-21-14/h7-8,10-12H,3-6,9H2,1-2H3,(H,18,19,20)/b11-10+