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

Systemtic Name: (E)-3-[3-bromanyl-4,5-bis(oxidanyl)phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (E)-2-(benzenesulfonyl)-3-(3-bromo-4,5-dihydroxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-(benzenesulfonyl)-3-(3-bromo-4,5-dihydroxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(benzenesulfonyl)-3-(3-bromo-4,5-dihydroxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-besyl-3-(3-bromo-4,5-dihydroxy-phenyl)acrylonitrile Formula: C15H10BrNO4S MolecularWeight: 380.2132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10BrNO4S/c16-13-7-10(8-14(18)15(13)19)6-12(9-17)22(20,21)11-4-2-1-3-5-11/h1-8,18-19H/b12-6+