(E)-3-(3-bromanyl-4-methoxy-phenyl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-4-methoxy-phenyl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-bromo-4-methoxy-phenyl)-2-(4-fluorobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-4-methoxyphenyl)-2-[(4-fluorophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-4-methoxyphenyl)-2-(4-fluorobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3-bromo-4-methoxy-phenyl)-2-(4-fluorobenzoyl)acrylonitrile Formula: C17H11BrFNO2 MolecularWeight: 360.177143

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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)F)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H11BrFNO2/c1-22-16-7-2-11(9-15(16)18)8-13(10-20)17(21)12-3-5-14(19)6-4-12/h2-9H,1H3/b13-8+