[1-(nitromethyl)cyclohexyl]sulfanylmethylbenzene

Systemtic Name: [1-(nitromethyl)cyclohexyl]sulfanylmethylbenzene Openeye Name: [1-(nitromethyl)cyclohexyl]sulfanylmethylbenzene CAS Name: [[1-(nitromethyl)cyclohexyl]thio]methylbenzene IUPAC Name: [1-(nitromethyl)cyclohexyl]sulfanylmethylbenzene Traditional Name: [[1-(nitromethyl)cyclohexyl]thio]methylbenzene Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C[N+](=O)[O-])SCC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)(C[N+](=O)[O-])SCC2=CC=CC=C2

InChI

InChI=1S/C14H19NO2S/c16-15(17)12-14(9-5-2-6-10-14)18-11-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2