3,6-dinitro-4-oxidanylidene-thiochromen-2-olate

Systemtic Name: 3,6-dinitro-4-oxidanylidene-thiochromen-2-olate Openeye Name: 3,6-dinitro-4-oxo-thiochromen-2-olate CAS Name: 3,6-dinitro-4-oxo-1-benzothiopyran-2-olate IUPAC Name: 3,6-dinitro-4-oxothiochromen-2-olate Traditional Name: 4-keto-3,6-dinitro-thiochromen-2-olate Formula: C9H3N2O6S- MolecularWeight: 267.19492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=C(S2)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=C(S2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H4N2O6S/c12-8-5-3-4(10(14)15)1-2-6(5)18-9(13)7(8)11(16)17/h1-3,13H/p-1