1-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-2,4-dinitro-benzene Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfanyl-2,4-dinitro-benzene CAS Name: 1-[(3-chloro-4-fluorophenyl)thio]-2,4-dinitrobenzene IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfanyl-2,4-dinitrobenzene Traditional Name: 1-[(3-chloro-4-fluoro-phenyl)thio]-2,4-dinitro-benzene Formula: C12H6ClFN2O4S MolecularWeight: 328.703443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C12H6ClFN2O4S/c13-9-6-8(2-3-10(9)14)21-12-4-1-7(15(17)18)5-11(12)16(19)20/h1-6H