1-(nitromethyl)-1-prop-2-enylsulfanyl-cycloheptane

Systemtic Name: 1-(nitromethyl)-1-prop-2-enylsulfanyl-cycloheptane Openeye Name: 1-allylsulfanyl-1-(nitromethyl)cycloheptane CAS Name: 1-(nitromethyl)-1-(prop-2-enylthio)cycloheptane IUPAC Name: 1-(nitromethyl)-1-prop-2-enylsulfanylcycloheptane Traditional Name: 1-(allylthio)-1-(nitromethyl)cycloheptane Formula: C11H19NO2S MolecularWeight: 229.33906

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1(CCCCCC1)C[N+](=O)[O-]

Isomeric SMILES

C=CCSC1(CCCCCC1)C[N+](=O)[O-]

InChI

InChI=1S/C11H19NO2S/c1-2-9-15-11(10-12(13)14)7-5-3-4-6-8-11/h2H,1,3-10H2