(E)-2-benzamido-3-[6-(2-bromanylphenoxy)pyridin-3-yl]prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-[6-(2-bromanylphenoxy)pyridin-3-yl]prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-[6-(2-bromophenoxy)-3-pyridyl]prop-2-enoic acid CAS Name: (E)-2-benzamido-3-[6-(2-bromophenoxy)-3-pyridinyl]-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-[6-(2-bromophenoxy)pyridin-3-yl]prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-[6-(2-bromophenoxy)-3-pyridyl]acrylic acid Formula: C21H15BrN2O4 MolecularWeight: 439.2588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CN=C(C=C2)OC3=CC=CC=C3Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CN=C(C=C2)OC3=CC=CC=C3Br)/C(=O)O

InChI

InChI=1S/C21H15BrN2O4/c22-16-8-4-5-9-18(16)28-19-11-10-14(13-23-19)12-17(21(26)27)24-20(25)15-6-2-1-3-7-15/h1-13H,(H,24,25)(H,26,27)/b17-12+