7,8-bis(chloranyl)-3-nitro-9-oxidanylidene-thioxanthene-1-carboxylic acid

Systemtic Name: 7,8-bis(chloranyl)-3-nitro-9-oxidanylidene-thioxanthene-1-carboxylic acid Openeye Name: 7,8-dichloro-3-nitro-9-oxo-thioxanthene-1-carboxylic acid CAS Name: 7,8-dichloro-3-nitro-9-oxo-1-thioxanthenecarboxylic acid IUPAC Name: 7,8-dichloro-3-nitro-9-oxothioxanthene-1-carboxylic acid Traditional Name: 7,8-dichloro-9-keto-3-nitro-thioxanthene-1-carboxylic acid Formula: C14H5Cl2NO5S MolecularWeight: 370.1642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1SC3=C(C2=O)C(=CC(=C3)[N+](=O)[O-])C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C2=C1SC3=C(C2=O)C(=CC(=C3)[N+](=O)[O-])C(=O)O)Cl)Cl

InChI

InChI=1S/C14H5Cl2NO5S/c15-7-1-2-8-11(12(7)16)13(18)10-6(14(19)20)3-5(17(21)22)4-9(10)23-8/h1-4H,(H,19,20)