(E)-3-[4-bromanyl-2-(2-methylimidazol-1-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-bromanyl-2-(2-methylimidazol-1-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-(2-methylimidazol-1-yl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-(2-methyl-1-imidazolyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-(2-methylimidazol-1-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-(2-methylimidazol-1-yl)phenyl]acrylic acid Formula: C13H11BrN2O2 MolecularWeight: 307.14264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=C(C=CC(=C2)Br)C=CC(=O)O

Isomeric SMILES

CC1=NC=CN1C2=C(C=CC(=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C13H11BrN2O2/c1-9-15-6-7-16(9)12-8-11(14)4-2-10(12)3-5-13(17)18/h2-8H,1H3,(H,17,18)/b5-3+