2-(3-chloranyl-4-fluoranyl-phenyl)-4,6-dinitro-1,2-benzothiazol-3-one

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)-4,6-dinitro-1,2-benzothiazol-3-one Openeye Name: 2-(3-chloro-4-fluoro-phenyl)-4,6-dinitro-1,2-benzothiazol-3-one CAS Name: 2-(3-chloro-4-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one IUPAC Name: 2-(3-chloro-4-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one Traditional Name: 2-(3-chloro-4-fluoro-phenyl)-4,6-dinitro-1,2-benzothiazol-3-one Formula: C13H5ClFN3O5S MolecularWeight: 369.712303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C(=O)C3=C(C=C(C=C3S2)[N+](=O)[O-])[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=C(C=C1N2C(=O)C3=C(C=C(C=C3S2)[N+](=O)[O-])[N+](=O)[O-])Cl)F

InChI

InChI=1S/C13H5ClFN3O5S/c14-8-3-6(1-2-9(8)15)16-13(19)12-10(18(22)23)4-7(17(20)21)5-11(12)24-16/h1-5H