1-(2-bromanylheptylsulfanyl)-4-nitro-benzene

Systemtic Name: 1-(2-bromanylheptylsulfanyl)-4-nitro-benzene Openeye Name: 1-(2-bromoheptylsulfanyl)-4-nitro-benzene CAS Name: 1-(2-bromoheptylthio)-4-nitrobenzene IUPAC Name: 1-(2-bromoheptylsulfanyl)-4-nitrobenzene Traditional Name: 1-(2-bromoheptylthio)-4-nitro-benzene Formula: C13H18BrNO2S MolecularWeight: 332.25652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CSC1=CC=C(C=C1)[N+](=O)[O-])Br

Isomeric SMILES

CCCCCC(CSC1=CC=C(C=C1)[N+](=O)[O-])Br

InChI

InChI=1S/C13H18BrNO2S/c1-2-3-4-5-11(14)10-18-13-8-6-12(7-9-13)15(16)17/h6-9,11H,2-5,10H2,1H3