2-[4-[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(3-chloro-4-fluoro-phenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(3-chloro-4-fluorophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(3-chloro-4-fluorophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(3-chloro-4-fluoro-phenyl)-3-keto-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C18H13ClFNO3 MolecularWeight: 345.752123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C2=CC(=C(C=C2)F)Cl)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC(=C(C=C2)F)Cl)OCC#N

InChI

InChI=1S/C18H13ClFNO3/c1-23-18-10-12(3-7-17(18)24-9-8-21)2-6-16(22)13-4-5-15(20)14(19)11-13/h2-7,10-11H,9H2,1H3/b6-2+