(2-nitro-1-pent-4-enylsulfanyl-ethyl)benzene

Systemtic Name: (2-nitro-1-pent-4-enylsulfanyl-ethyl)benzene Openeye Name: (2-nitro-1-pent-4-enylsulfanyl-ethyl)benzene CAS Name: [2-nitro-1-(pent-4-enylthio)ethyl]benzene IUPAC Name: (2-nitro-1-pent-4-enylsulfanylethyl)benzene Traditional Name: [2-nitro-1-(pent-4-enylthio)ethyl]benzene Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCSC(C[N+](=O)[O-])C1=CC=CC=C1

Isomeric SMILES

C=CCCCSC(C[N+](=O)[O-])C1=CC=CC=C1

InChI

InChI=1S/C13H17NO2S/c1-2-3-7-10-17-13(11-14(15)16)12-8-5-4-6-9-12/h2,4-6,8-9,13H,1,3,7,10-11H2