(3-nitro-2-prop-2-enylsulfanyl-propoxy)benzene

Systemtic Name: (3-nitro-2-prop-2-enylsulfanyl-propoxy)benzene Openeye Name: (2-allylsulfanyl-3-nitro-propoxy)benzene CAS Name: [3-nitro-2-(prop-2-enylthio)propoxy]benzene IUPAC Name: (3-nitro-2-prop-2-enylsulfanylpropoxy)benzene Traditional Name: [2-(allylthio)-3-nitro-propoxy]benzene Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC(C[N+](=O)[O-])COC1=CC=CC=C1

Isomeric SMILES

C=CCSC(C[N+](=O)[O-])COC1=CC=CC=C1

InChI

InChI=1S/C12H15NO3S/c1-2-8-17-12(9-13(14)15)10-16-11-6-4-3-5-7-11/h2-7,12H,1,8-10H2