(E)-3-[4-(2,2-dimethylpropanoylamino)pyridin-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2,2-dimethylpropanoylamino)pyridin-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2,2-dimethylpropanoylamino)-3-pyridyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(2,2-dimethyl-1-oxopropyl)amino]-3-pyridinyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2,2-dimethylpropanoylamino)pyridin-3-yl]prop-2-enoic acid Traditional Name: (E)-3-[4-(pivaloylamino)-3-pyridyl]acrylic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=NC=C1)C=CC(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=NC=C1)/C=C/C(=O)O

InChI

InChI=1S/C13H16N2O3/c1-13(2,3)12(18)15-10-6-7-14-8-9(10)4-5-11(16)17/h4-8H,1-3H3,(H,16,17)(H,14,15,18)/b5-4+