4-methyl-2-(4-nitrophenyl)sulfanyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-methyl-2-(4-nitrophenyl)sulfanyl-cyclohexane-1-carbonitrile Openeye Name: 4-methyl-2-(4-nitrophenyl)sulfanyl-cyclohexanecarbonitrile CAS Name: 4-methyl-2-[(4-nitrophenyl)thio]-1-cyclohexanecarbonitrile IUPAC Name: 4-methyl-2-(4-nitrophenyl)sulfanylcyclohexane-1-carbonitrile Traditional Name: 4-methyl-2-[(4-nitrophenyl)thio]cyclohexanecarbonitrile Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)SC2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1CCC(C(C1)SC2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H16N2O2S/c1-10-2-3-11(9-15)14(8-10)19-13-6-4-12(5-7-13)16(17)18/h4-7,10-11,14H,2-3,8H2,1H3