2-(4-nitrophenyl)sulfanylcyclohexane-1-carbonitrile

Systemtic Name: 2-(4-nitrophenyl)sulfanylcyclohexane-1-carbonitrile Openeye Name: 2-(4-nitrophenyl)sulfanylcyclohexanecarbonitrile CAS Name: 2-[(4-nitrophenyl)thio]-1-cyclohexanecarbonitrile IUPAC Name: 2-(4-nitrophenyl)sulfanylcyclohexane-1-carbonitrile Traditional Name: 2-[(4-nitrophenyl)thio]cyclohexanecarbonitrile Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C#N)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C(C1)C#N)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O2S/c14-9-10-3-1-2-4-13(10)18-12-7-5-11(6-8-12)15(16)17/h5-8,10,13H,1-4H2