methyl (2Z)-2-[(2-chloranyl-4-fluoranyl-phenyl)methylidene]-3-oxidanylidene-5-pyridin-4-yl-pentanoate

Systemtic Name: methyl (2Z)-2-[(2-chloranyl-4-fluoranyl-phenyl)methylidene]-3-oxidanylidene-5-pyridin-4-yl-pentanoate Openeye Name: methyl (2Z)-2-[(2-chloro-4-fluoro-phenyl)methylene]-3-oxo-5-(4-pyridyl)pentanoate CAS Name: (2Z)-2-[(2-chloro-4-fluorophenyl)methylidene]-3-oxo-5-pyridin-4-ylpentanoic acid methyl ester IUPAC Name: methyl (2Z)-2-[(2-chloro-4-fluorophenyl)methylidene]-3-oxo-5-pyridin-4-ylpentanoate Traditional Name: (Z)-3-(2-chloro-4-fluoro-phenyl)-2-[3-(4-pyridyl)propanoyl]acrylic acid methyl ester Formula: C18H15ClFNO3 MolecularWeight: 347.768003

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(C=C(C=C1)F)Cl)C(=O)CCC2=CC=NC=C2

Isomeric SMILES

COC(=O)/C(=C\C1=C(C=C(C=C1)F)Cl)/C(=O)CCC2=CC=NC=C2

InChI

InChI=1S/C18H15ClFNO3/c1-24-18(23)15(10-13-3-4-14(20)11-16(13)19)17(22)5-2-12-6-8-21-9-7-12/h3-4,6-11H,2,5H2,1H3/b15-10-