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

Systemtic Name: (E)-3-(3-bromanyl-4-methoxy-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(3-bromo-4-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(3-bromo-4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(3-bromo-4-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(3-bromo-4-methoxy-phenyl)acrylonitrile Formula: C17H12BrNO2 MolecularWeight: 342.18668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrNO2/c1-21-16-8-7-12(10-15(16)18)9-14(11-19)17(20)13-5-3-2-4-6-13/h2-10H,1H3/b14-9+