(E)-3-(5-acetyloxy-4,6-dimethyl-pyridin-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(5-acetyloxy-4,6-dimethyl-pyridin-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(5-acetoxy-4,6-dimethyl-3-pyridyl)prop-2-enoic acid CAS Name: (E)-3-(5-acetyloxy-4,6-dimethyl-3-pyridinyl)-2-propenoic acid IUPAC Name: (E)-3-(5-acetyloxy-4,6-dimethylpyridin-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(5-acetoxy-4,6-dimethyl-3-pyridyl)acrylic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1C=CC(=O)O)C)OC(=O)C

Isomeric SMILES

CC1=C(C(=NC=C1/C=C/C(=O)O)C)OC(=O)C

InChI

InChI=1S/C12H13NO4/c1-7-10(4-5-11(15)16)6-13-8(2)12(7)17-9(3)14/h4-6H,1-3H3,(H,15,16)/b5-4+