1-butan-2-ylsulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-butan-2-ylsulfanyl-2,4-dinitro-benzene Openeye Name: 2,4-dinitro-1-sec-butylsulfanyl-benzene CAS Name: 1-(butan-2-ylthio)-2,4-dinitrobenzene IUPAC Name: 1-butan-2-ylsulfanyl-2,4-dinitrobenzene Traditional Name: 2,4-dinitro-1-(sec-butylthio)benzene Formula: C10H12N2O4S MolecularWeight: 256.27828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O4S/c1-3-7(2)17-10-5-4-8(11(13)14)6-9(10)12(15)16/h4-7H,3H2,1-2H3