[2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-fluoranylbenzoate

Systemtic Name: [2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-fluoranylbenzoate Openeye Name: [2-methoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [2-methoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] ester Formula: C21H16FNO3 MolecularWeight: 349.355043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC2=CC=NC=C2)OC(=O)C3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C2=CC=NC=C2)OC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H16FNO3/c1-25-20-14-16(7-6-15-10-12-23-13-11-15)8-9-19(20)26-21(24)17-4-2-3-5-18(17)22/h2-14H,1H3/b7-6+