(4-cyano-4-phenyl-oxetan-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (4-cyano-4-phenyl-oxetan-2-yl) 4-methylbenzenesulfonate Openeye Name: (4-cyano-4-phenyl-oxetan-2-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-cyano-4-phenyl-2-oxetanyl) ester IUPAC Name: (4-cyano-4-phenyloxetan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-cyano-4-phenyl-oxetan-2-yl) ester Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(O2)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(O2)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C17H15NO4S/c1-13-7-9-15(10-8-13)23(19,20)22-16-11-17(12-18,21-16)14-5-3-2-4-6-14/h2-10,16H,11H2,1H3