(E)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(3,5-dibromo-2-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(3,5-dibromo-2-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(3,5-dibromo-2-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(3,5-dibromo-2-methoxy-phenyl)acrylonitrile Formula: C17H11Br2NO2 MolecularWeight: 421.08274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=C(C#N)C(=O)C2=CC=CC=C2)Br)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H11Br2NO2/c1-22-17-12(8-14(18)9-15(17)19)7-13(10-20)16(21)11-5-3-2-4-6-11/h2-9H,1H3/b13-7+