3-[[4-[(Z)-2-(2-fluorophenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate

Systemtic Name: 3-[[4-[(Z)-2-(2-fluorophenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate Openeye Name: 3-[[4-[(Z)-2-(2-fluorophenyl)vinyl]pyridin-1-ium-1-yl]methyl]benzoate CAS Name: 3-[[4-[(Z)-2-(2-fluorophenyl)ethenyl]-1-pyridin-1-iumyl]methyl]benzoate IUPAC Name: 3-[[4-[(Z)-2-(2-fluorophenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate Traditional Name: 3-[[4-[(Z)-2-(2-fluorophenyl)vinyl]pyridin-1-ium-1-yl]methyl]benzoate Formula: C21H16FNO2 MolecularWeight: 333.355643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC2=CC=[N+](C=C2)CC3=CC=CC(=C3)C(=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)/C=C\C2=CC=[N+](C=C2)CC3=CC=CC(=C3)C(=O)[O-])F

InChI

InChI=1S/C21H16FNO2/c22-20-7-2-1-5-18(20)9-8-16-10-12-23(13-11-16)15-17-4-3-6-19(14-17)21(24)25/h1-14H,15H2/b9-8-