(2-ethoxy-4-methanoyl-phenyl) 4-cyanobenzenesulfonate

Systemtic Name: (2-ethoxy-4-methanoyl-phenyl) 4-cyanobenzenesulfonate Openeye Name: (2-ethoxy-4-formyl-phenyl) 4-cyanobenzenesulfonate CAS Name: 4-cyanobenzenesulfonic acid (2-ethoxy-4-formylphenyl) ester IUPAC Name: (2-ethoxy-4-formylphenyl) 4-cyanobenzenesulfonate Traditional Name: 4-cyanobenzenesulfonic acid (2-ethoxy-4-formyl-phenyl) ester Formula: C16H13NO5S MolecularWeight: 331.34312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OS(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OS(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO5S/c1-2-21-16-9-13(11-18)5-8-15(16)22-23(19,20)14-6-3-12(10-17)4-7-14/h3-9,11H,2H2,1H3