4-[(Z)-1-cyano-2-[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]ethenyl]benzoate

Systemtic Name: 4-[(Z)-1-cyano-2-[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]ethenyl]benzoate Openeye Name: 4-[(Z)-1-cyano-2-[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]vinyl]benzoate CAS Name: 4-[(Z)-1-cyano-2-[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]ethenyl]benzoate IUPAC Name: 4-[(Z)-1-cyano-2-[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]ethenyl]benzoate Traditional Name: 4-[(Z)-1-cyano-2-[3-ethoxy-4-(3-fluorobenzyl)oxy-phenyl]vinyl]benzoate Formula: C25H19FNO4- MolecularWeight: 416.421063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)[O-])OCC3=CC(=CC=C3)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C2=CC=C(C=C2)C(=O)[O-])OCC3=CC(=CC=C3)F

InChI

InChI=1S/C25H20FNO4/c1-2-30-24-14-17(6-11-23(24)31-16-18-4-3-5-22(26)13-18)12-21(15-27)19-7-9-20(10-8-19)25(28)29/h3-14H,2,16H2,1H3,(H,28,29)/p-1/b21-12+