(E)-3,5,5-trimethyl-2-pyrimidin-5-yl-hex-2-enoic acid

Systemtic Name: (E)-3,5,5-trimethyl-2-pyrimidin-5-yl-hex-2-enoic acid Openeye Name: (E)-3,5,5-trimethyl-2-pyrimidin-5-yl-hex-2-enoic acid CAS Name: (E)-3,5,5-trimethyl-2-(5-pyrimidinyl)-2-hexenoic acid IUPAC Name: (E)-3,5,5-trimethyl-2-pyrimidin-5-ylhex-2-enoic acid Traditional Name: (E)-3,5,5-trimethyl-2-(5-pyrimidyl)hex-2-enoic acid Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CN=CN=C1)C(=O)O)CC(C)(C)C

Isomeric SMILES

C/C(=C(/C1=CN=CN=C1)\C(=O)O)/CC(C)(C)C

InChI

InChI=1S/C13H18N2O2/c1-9(5-13(2,3)4)11(12(16)17)10-6-14-8-15-7-10/h6-8H,5H2,1-4H3,(H,16,17)/b11-9+