3-[2,3-bis(bromanyl)-5-methoxy-4-oxidanyl-phenyl]-2-(2-fluorophenyl)prop-2-enenitrile

Systemtic Name: 3-[2,3-bis(bromanyl)-5-methoxy-4-oxidanyl-phenyl]-2-(2-fluorophenyl)prop-2-enenitrile Openeye Name: 3-(2,3-dibromo-4-hydroxy-5-methoxy-phenyl)-2-(2-fluorophenyl)prop-2-enenitrile CAS Name: 3-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-2-(2-fluorophenyl)-2-propenenitrile IUPAC Name: 3-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-2-(2-fluorophenyl)prop-2-enenitrile Traditional Name: 3-(2,3-dibromo-4-hydroxy-5-methoxy-phenyl)-2-(2-fluorophenyl)acrylonitrile Formula: C16H10Br2FNO2 MolecularWeight: 427.062503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C=C(C#N)C2=CC=CC=C2F)Br)Br)O

Isomeric SMILES

COC1=C(C(=C(C(=C1)C=C(C#N)C2=CC=CC=C2F)Br)Br)O

InChI

InChI=1S/C16H10Br2FNO2/c1-22-13-7-9(14(17)15(18)16(13)21)6-10(8-20)11-4-2-3-5-12(11)19/h2-7,21H,1H3