(E)-3-(2-pyridin-3-ylpyrimidin-5-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-pyridin-3-ylpyrimidin-5-yl)prop-2-enoic acid Openeye Name: (E)-3-[2-(3-pyridyl)pyrimidin-5-yl]prop-2-enoic acid CAS Name: (E)-3-[2-(3-pyridinyl)-5-pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-(2-pyridin-3-ylpyrimidin-5-yl)prop-2-enoic acid Traditional Name: (E)-3-[2-(3-pyridyl)pyrimidin-5-yl]acrylic acid Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC=C(C=N2)C=CC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C2=NC=C(C=N2)/C=C/C(=O)O

InChI

InChI=1S/C12H9N3O2/c16-11(17)4-3-9-6-14-12(15-7-9)10-2-1-5-13-8-10/h1-8H,(H,16,17)/b4-3+