3-[6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-[6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[6-[(E)-2-(2-furyl)vinyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid CAS Name: 3-[6-[(E)-2-(2-furanyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid IUPAC Name: 3-[6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid Traditional Name: 3-[6-[(E)-2-(2-furyl)vinyl]-4-keto-2-methyl-1H-pyrimidin-5-yl]propionic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=CO2)CCC(=O)O

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=CO2)CCC(=O)O

InChI

InChI=1S/C14H14N2O4/c1-9-15-12(6-4-10-3-2-8-20-10)11(14(19)16-9)5-7-13(17)18/h2-4,6,8H,5,7H2,1H3,(H,17,18)(H,15,16,19)/b6-4+