5-cyano-2-[(E)-2-(4-cyano-2-sulfo-phenyl)ethenyl]benzenesulfonic acid

Systemtic Name: 5-cyano-2-[(E)-2-(4-cyano-2-sulfo-phenyl)ethenyl]benzenesulfonic acid Openeye Name: 5-cyano-2-[(E)-2-(4-cyano-2-sulfo-phenyl)vinyl]benzenesulfonic acid CAS Name: 5-cyano-2-[(E)-2-(4-cyano-2-sulfophenyl)ethenyl]benzenesulfonic acid IUPAC Name: 5-cyano-2-[(E)-2-(4-cyano-2-sulfophenyl)ethenyl]benzenesulfonic acid Traditional Name: 5-cyano-2-[(E)-2-(4-cyano-2-sulfo-phenyl)vinyl]besylic acid Formula: C16H10N2O6S2 MolecularWeight: 390.3904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)C#N)S(=O)(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H10N2O6S2/c17-9-11-1-3-13(15(7-11)25(19,20)21)5-6-14-4-2-12(10-18)8-16(14)26(22,23)24/h1-8H,(H,19,20,21)(H,22,23,24)/b6-5+