(E)-2-(4-chlorophenyl)carbonyl-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-chlorophenyl)carbonyl-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-chlorobenzoyl)-3-(3-fluoro-4-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[(4-chlorophenyl)-oxomethyl]-3-(3-fluoro-4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-chlorobenzoyl)-3-(3-fluoro-4-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-chlorobenzoyl)-3-(3-fluoro-4-methoxy-phenyl)acrylonitrile Formula: C17H11ClFNO2 MolecularWeight: 315.726143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClFNO2/c1-22-16-7-2-11(9-15(16)19)8-13(10-20)17(21)12-3-5-14(18)6-4-12/h2-9H,1H3/b13-8+