2-(3-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one

Systemtic Name: 2-(3-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one Openeye Name: 2-(3-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one CAS Name: 2-(3-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one IUPAC Name: 2-(3-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one Traditional Name: 2-(3-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-one Formula: C13H6FN3O5S MolecularWeight: 335.267243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)N2C(=O)C3=C(C=C(C=C3S2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)F)N2C(=O)C3=C(C=C(C=C3S2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H6FN3O5S/c14-7-2-1-3-8(4-7)15-13(18)12-10(17(21)22)5-9(16(19)20)6-11(12)23-15/h1-6H