(E)-3-(2-butylpyrimidin-4-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-butylpyrimidin-4-yl)prop-2-enoic acid Openeye Name: (E)-3-(2-butylpyrimidin-4-yl)prop-2-enoic acid CAS Name: (E)-3-(2-butyl-4-pyrimidinyl)-2-propenoic acid IUPAC Name: (E)-3-(2-butylpyrimidin-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(2-butylpyrimidin-4-yl)acrylic acid Formula: C11H14N2O2 MolecularWeight: 206.24106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=CC(=N1)C=CC(=O)O

Isomeric SMILES

CCCCC1=NC=CC(=N1)/C=C/C(=O)O

InChI

InChI=1S/C11H14N2O2/c1-2-3-4-10-12-8-7-9(13-10)5-6-11(14)15/h5-8H,2-4H2,1H3,(H,14,15)/b6-5+