[2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [2-ethoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [2-ethoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] ester Formula: C22H17ClFNO3 MolecularWeight: 397.826683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=CC=NC=C2)OC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=CC=NC=C2)OC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H17ClFNO3/c1-2-27-20-14-16(7-6-15-10-12-25-13-11-15)8-9-19(20)28-22(26)21-17(23)4-3-5-18(21)24/h3-14H,2H2,1H3/b7-6+