(E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-mesyl-acrylonitrile Formula: C11H10BrNO4S MolecularWeight: 332.1704

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C11H10BrNO4S/c1-17-11-5-9(12)7(4-10(11)14)3-8(6-13)18(2,15)16/h3-5,14H,1-2H3/b8-3+