[4-[(E)-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)iminomethyl]-2-methoxy-phenyl] 4-fluoranylbenzoate

Systemtic Name: [4-[(E)-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)iminomethyl]-2-methoxy-phenyl] 4-fluoranylbenzoate Openeye Name: [4-[(E)-(3-cyano-4,6-dimethyl-2-oxo-1-pyridyl)iminomethyl]-2-methoxy-phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[(E)-(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)iminomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(3-cyano-4,6-dimethyl-2-oxopyridin-1-yl)iminomethyl]-2-methoxyphenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[(E)-(3-cyano-2-keto-4,6-dimethyl-1-pyridyl)iminomethyl]-2-methoxy-phenyl] ester Formula: C23H18FN3O4 MolecularWeight: 419.405123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1N=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)F)OC)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1/N=C/C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)F)OC)C#N)C

InChI

InChI=1S/C23H18FN3O4/c1-14-10-15(2)27(22(28)19(14)12-25)26-13-16-4-9-20(21(11-16)30-3)31-23(29)17-5-7-18(24)8-6-17/h4-11,13H,1-3H3/b26-13+