(E)-3-[2-cyano-5-(pyridin-3-ylmethoxy)phenyl]-2-phenyl-prop-2-enoic acid

Systemtic Name: (E)-3-[2-cyano-5-(pyridin-3-ylmethoxy)phenyl]-2-phenyl-prop-2-enoic acid Openeye Name: (E)-3-[2-cyano-5-(3-pyridylmethoxy)phenyl]-2-phenyl-prop-2-enoic acid CAS Name: (E)-3-[2-cyano-5-(3-pyridinylmethoxy)phenyl]-2-phenyl-2-propenoic acid IUPAC Name: (E)-3-[2-cyano-5-(pyridin-3-ylmethoxy)phenyl]-2-phenylprop-2-enoic acid Traditional Name: (E)-3-[2-cyano-5-(3-pyridylmethoxy)phenyl]-2-phenyl-acrylic acid Formula: C22H16N2O3 MolecularWeight: 356.37404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=C(C=CC(=C2)OCC3=CN=CC=C3)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C2=C(C=CC(=C2)OCC3=CN=CC=C3)C#N)/C(=O)O

InChI

InChI=1S/C22H16N2O3/c23-13-18-8-9-20(27-15-16-5-4-10-24-14-16)11-19(18)12-21(22(25)26)17-6-2-1-3-7-17/h1-12,14H,15H2,(H,25,26)/b21-12+