(E)-2-(4-bromophenyl)sulfonyl-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-(3-hydroxy-4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-(3-hydroxy-4-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-(3-hydroxy-4-methoxy-phenyl)acrylonitrile Formula: C16H12BrNO4S MolecularWeight: 394.23978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Br)O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)Br)O

InChI

InChI=1S/C16H12BrNO4S/c1-22-16-7-2-11(9-15(16)19)8-14(10-18)23(20,21)13-5-3-12(17)4-6-13/h2-9,19H,1H3/b14-8+