(E)-3-[2-(4-methylphenyl)pyrimidin-5-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(4-methylphenyl)pyrimidin-5-yl]prop-2-enoic acid Openeye Name: (E)-3-[2-(p-tolyl)pyrimidin-5-yl]prop-2-enoic acid CAS Name: (E)-3-[2-(4-methylphenyl)-5-pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(4-methylphenyl)pyrimidin-5-yl]prop-2-enoic acid Traditional Name: (E)-3-[2-(p-tolyl)pyrimidin-5-yl]acrylic acid Formula: C14H12N2O2 MolecularWeight: 240.25728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC=C(C=N2)C=CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC=C(C=N2)/C=C/C(=O)O

InChI

InChI=1S/C14H12N2O2/c1-10-2-5-12(6-3-10)14-15-8-11(9-16-14)4-7-13(17)18/h2-9H,1H3,(H,17,18)/b7-4+