3-[4-(2-cyanophenyl)phenyl]-2-(furan-3-ylcarbonylamino)propanoic acid

Systemtic Name: 3-[4-(2-cyanophenyl)phenyl]-2-(furan-3-ylcarbonylamino)propanoic acid Openeye Name: 3-[4-(2-cyanophenyl)phenyl]-2-(furan-3-carbonylamino)propanoic acid CAS Name: 3-[4-(2-cyanophenyl)phenyl]-2-[[3-furanyl(oxo)methyl]amino]propanoic acid IUPAC Name: 3-[4-(2-cyanophenyl)phenyl]-2-(furan-3-carbonylamino)propanoic acid Traditional Name: 3-[4-(2-cyanophenyl)phenyl]-2-(3-furoylamino)propionic acid Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=COC=C3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=COC=C3

InChI

InChI=1S/C21H16N2O4/c22-12-16-3-1-2-4-18(16)15-7-5-14(6-8-15)11-19(21(25)26)23-20(24)17-9-10-27-13-17/h1-10,13,19H,11H2,(H,23,24)(H,25,26)