4-[[(E)-2-cyano-3-[5-(2-fluorophenyl)furan-2-yl]prop-2-enoyl]amino]benzoate

Systemtic Name: 4-[[(E)-2-cyano-3-[5-(2-fluorophenyl)furan-2-yl]prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(E)-2-cyano-3-[5-(2-fluorophenyl)-2-furyl]prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-[5-(2-fluorophenyl)-2-furanyl]-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-2-cyano-3-[5-(2-fluorophenyl)furan-2-yl]prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-[5-(2-fluorophenyl)-2-furyl]acryloyl]amino]benzoate Formula: C21H12FN2O4- MolecularWeight: 375.329383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)C(=O)[O-])F

InChI

InChI=1S/C21H13FN2O4/c22-18-4-2-1-3-17(18)19-10-9-16(28-19)11-14(12-23)20(25)24-15-7-5-13(6-8-15)21(26)27/h1-11H,(H,24,25)(H,26,27)/p-1/b14-11+