4-(phenylsulfonyl)oxane-4-carbonitrile

Systemtic Name: 4-(phenylsulfonyl)oxane-4-carbonitrile Openeye Name: 4-(benzenesulfonyl)tetrahydropyran-4-carbonitrile CAS Name: 4-(benzenesulfonyl)-4-oxanecarbonitrile IUPAC Name: 4-(benzenesulfonyl)oxane-4-carbonitrile Traditional Name: 4-besyltetrahydropyran-4-carbonitrile Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1COCCC1(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO3S/c13-10-12(6-8-16-9-7-12)17(14,15)11-4-2-1-3-5-11/h1-5H,6-9H2