(E)-3-(5-bromanyl-2-methoxy-phenyl)-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-2-mesyl-acrylonitrile Formula: C11H10BrNO3S MolecularWeight: 316.171

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=C(C#N)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C11H10BrNO3S/c1-16-11-4-3-9(12)5-8(11)6-10(7-13)17(2,14)15/h3-6H,1-2H3/b10-6+