(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(5-bromo-2-fluoro-phenyl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-2-tosyl-acrylonitrile Formula: C16H11BrFNO2S MolecularWeight: 380.231443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(C=CC(=C2)Br)F)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=C(C=CC(=C2)Br)F)/C#N

InChI

InChI=1S/C16H11BrFNO2S/c1-11-2-5-14(6-3-11)22(20,21)15(10-19)9-12-8-13(17)4-7-16(12)18/h2-9H,1H3/b15-9+