(1E,3E)-4-cyano-1-phenyl-buta-1,3-diene-2-sulfonic acid

Systemtic Name: (1E,3E)-4-cyano-1-phenyl-buta-1,3-diene-2-sulfonic acid Openeye Name: (1E,3E)-4-cyano-1-phenyl-buta-1,3-diene-2-sulfonic acid CAS Name: (1E,3E)-4-cyano-1-phenyl-2-buta-1,3-dienesulfonic acid IUPAC Name: (1E,3E)-4-cyano-1-phenylbuta-1,3-diene-2-sulfonic acid Traditional Name: (1E,3E)-4-cyano-1-phenyl-buta-1,3-diene-2-sulfonic acid Formula: C11H9NO3S MolecularWeight: 235.25906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C=CC#N)S(=O)(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO3S/c12-8-4-7-11(16(13,14)15)9-10-5-2-1-3-6-10/h1-7,9H,(H,13,14,15)/b7-4+,11-9+