1-nitro-2-(1-nitropropylsulfanyl)benzene

Systemtic Name: 1-nitro-2-(1-nitropropylsulfanyl)benzene Openeye Name: 1-nitro-2-(1-nitropropylsulfanyl)benzene CAS Name: 1-nitro-2-(1-nitropropylthio)benzene IUPAC Name: 1-nitro-2-(1-nitropropylsulfanyl)benzene Traditional Name: 1-nitro-2-(1-nitropropylthio)benzene Formula: C9H10N2O4S MolecularWeight: 242.2517

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Descriptors Computed from Structure

Canonical SMILES:

CCC([N+](=O)[O-])SC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCC([N+](=O)[O-])SC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O4S/c1-2-9(11(14)15)16-8-6-4-3-5-7(8)10(12)13/h3-6,9H,2H2,1H3