1-nitro-4-prop-2-enylsulfanyl-butane

Systemtic Name: 1-nitro-4-prop-2-enylsulfanyl-butane Openeye Name: 1-allylsulfanyl-4-nitro-butane CAS Name: 1-nitro-4-(prop-2-enylthio)butane IUPAC Name: 1-nitro-4-prop-2-enylsulfanylbutane Traditional Name: 1-(allylthio)-4-nitro-butane Formula: C7H13NO2S MolecularWeight: 175.24862

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSCCCC[N+](=O)[O-]

Isomeric SMILES

C=CCSCCCC[N+](=O)[O-]

InChI

InChI=1S/C7H13NO2S/c1-2-6-11-7-4-3-5-8(9)10/h2H,1,3-7H2