[(E)-[cyano(thiophen-2-yl)methylidene]amino] 4-oxidanylbenzenesulfonate

Systemtic Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] 4-oxidanylbenzenesulfonate Openeye Name: [(E)-[cyano(2-thienyl)methylene]amino] 4-hydroxybenzenesulfonate CAS Name: 4-hydroxybenzenesulfonic acid [(E)-[cyano(thiophen-2-yl)methylidene]amino] ester IUPAC Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] 4-hydroxybenzenesulfonate Traditional Name: 4-hydroxybenzenesulfonic acid [(E)-[cyano(2-thienyl)methylene]amino] ester Formula: C12H8N2O4S2 MolecularWeight: 308.33292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=NOS(=O)(=O)C2=CC=C(C=C2)O)C#N

Isomeric SMILES

C1=CSC(=C1)/C(=N/OS(=O)(=O)C2=CC=C(C=C2)O)/C#N

InChI

InChI=1S/C12H8N2O4S2/c13-8-11(12-2-1-7-19-12)14-18-20(16,17)10-5-3-9(15)4-6-10/h1-7,15H/b14-11+