(4-pyridin-2-yloxyphenyl) 3-cyanobenzenesulfonate

Systemtic Name: (4-pyridin-2-yloxyphenyl) 3-cyanobenzenesulfonate Openeye Name: [4-(2-pyridyloxy)phenyl] 3-cyanobenzenesulfonate CAS Name: 3-cyanobenzenesulfonic acid [4-(2-pyridinyloxy)phenyl] ester IUPAC Name: (4-pyridin-2-yloxyphenyl) 3-cyanobenzenesulfonate Traditional Name: 3-cyanobenzenesulfonic acid [4-(2-pyridyloxy)phenyl] ester Formula: C18H12N2O4S MolecularWeight: 352.36388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)OC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=NC(=C1)OC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H12N2O4S/c19-13-14-4-3-5-17(12-14)25(21,22)24-16-9-7-15(8-10-16)23-18-6-1-2-11-20-18/h1-12H