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

Systemtic Name: 3-[6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[6-[(E)-2-(4-hydroxyphenyl)vinyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid CAS Name: 3-[6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid IUPAC Name: 3-[6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid Traditional Name: 3-[6-[(E)-2-(4-hydroxyphenyl)vinyl]-4-keto-2-methyl-1H-pyrimidin-5-yl]propionic acid Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=C(C=C2)O)CCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O4/c1-10-17-14(8-4-11-2-5-12(19)6-3-11)13(16(22)18-10)7-9-15(20)21/h2-6,8,19H,7,9H2,1H3,(H,20,21)(H,17,18,22)/b8-4+