(E)-3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-2-(2-fluorophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-2-(2-fluorophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-(2-fluorobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-[(2-fluorophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-(2-fluorobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-(2-fluorobenzoyl)acrylonitrile Formula: C19H15BrFNO3 MolecularWeight: 404.229703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)C2=CC=CC=C2F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)/C=C(\C#N)/C(=O)C2=CC=CC=C2F)OC

InChI

InChI=1S/C19H15BrFNO3/c1-3-25-19-15(20)9-12(10-17(19)24-2)8-13(11-22)18(23)14-6-4-5-7-16(14)21/h4-10H,3H2,1-2H3/b13-8+