(Z)-3-[3-bromanyl-4,5-bis(oxidanyl)phenyl]-2-thiophen-3-ylsulfonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[3-bromanyl-4,5-bis(oxidanyl)phenyl]-2-thiophen-3-ylsulfonyl-prop-2-enenitrile Openeye Name: (Z)-3-(3-bromo-4,5-dihydroxy-phenyl)-2-(3-thienylsulfonyl)prop-2-enenitrile CAS Name: (Z)-3-(3-bromo-4,5-dihydroxyphenyl)-2-(3-thiophenylsulfonyl)-2-propenenitrile IUPAC Name: (Z)-3-(3-bromo-4,5-dihydroxyphenyl)-2-thiophen-3-ylsulfonylprop-2-enenitrile Traditional Name: (Z)-3-(3-bromo-4,5-dihydroxy-phenyl)-2-(3-thienylsulfonyl)acrylonitrile Formula: C13H8BrNO4S2 MolecularWeight: 386.24092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1S(=O)(=O)C(=CC2=CC(=C(C(=C2)Br)O)O)C#N

Isomeric SMILES

C1=CSC=C1S(=O)(=O)/C(=C\C2=CC(=C(C(=C2)Br)O)O)/C#N

InChI

InChI=1S/C13H8BrNO4S2/c14-11-4-8(5-12(16)13(11)17)3-10(6-15)21(18,19)9-1-2-20-7-9/h1-5,7,16-17H/b10-3-