1-(3-fluoranyl-2,3-dimethyl-butyl)sulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-(3-fluoranyl-2,3-dimethyl-butyl)sulfanyl-2,4-dinitro-benzene Openeye Name: 1-(3-fluoro-2,3-dimethyl-butyl)sulfanyl-2,4-dinitro-benzene CAS Name: 1-[(3-fluoro-2,3-dimethylbutyl)thio]-2,4-dinitrobenzene IUPAC Name: 1-(3-fluoro-2,3-dimethylbutyl)sulfanyl-2,4-dinitrobenzene Traditional Name: 1-[(3-fluoro-2,3-dimethyl-butyl)thio]-2,4-dinitro-benzene Formula: C12H15FN2O4S MolecularWeight: 302.321903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15FN2O4S/c1-8(12(2,3)13)7-20-11-5-4-9(14(16)17)6-10(11)15(18)19/h4-6,8H,7H2,1-3H3