methyl 2-[(E)-2-(4-bromophenyl)sulfonyl-2-cyano-ethenyl]benzoate

Systemtic Name: methyl 2-[(E)-2-(4-bromophenyl)sulfonyl-2-cyano-ethenyl]benzoate Openeye Name: methyl 2-[(E)-2-(4-bromophenyl)sulfonyl-2-cyano-vinyl]benzoate CAS Name: 2-[(E)-2-(4-bromophenyl)sulfonyl-2-cyanoethenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(E)-2-(4-bromophenyl)sulfonyl-2-cyanoethenyl]benzoate Traditional Name: 2-[(E)-2-brosyl-2-cyano-vinyl]benzoic acid methyl ester Formula: C17H12BrNO4S MolecularWeight: 406.25048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrNO4S/c1-23-17(20)16-5-3-2-4-12(16)10-15(11-19)24(21,22)14-8-6-13(18)7-9-14/h2-10H,1H3/b15-10+