1-[3,4-bis(fluoranyl)phenyl]sulfonylcycloheptane-1-carbonitrile

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]sulfonylcycloheptane-1-carbonitrile Openeye Name: 1-(3,4-difluorophenyl)sulfonylcycloheptanecarbonitrile CAS Name: 1-(3,4-difluorophenyl)sulfonyl-1-cycloheptanecarbonitrile IUPAC Name: 1-(3,4-difluorophenyl)sulfonylcycloheptane-1-carbonitrile Traditional Name: 1-(3,4-difluorophenyl)sulfonylcycloheptanecarbonitrile Formula: C14H15F2NO2S MolecularWeight: 299.336206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)S(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

C1CCCC(CC1)(C#N)S(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C14H15F2NO2S/c15-12-6-5-11(9-13(12)16)20(18,19)14(10-17)7-3-1-2-4-8-14/h5-6,9H,1-4,7-8H2