8-nitro-1-oxidanylidene-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid

Systemtic Name: 8-nitro-1-oxidanylidene-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid Openeye Name: 8-nitro-1-oxo-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid CAS Name: 8-nitro-1-oxo-4-pyrimido[6,1-b][1,3]benzothiazolecarboxylic acid IUPAC Name: 8-nitro-1-oxopyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid Traditional Name: 1-keto-8-nitro-pyrimido[6,1-b][1,3]benzothiazole-4-carboxylic acid Formula: C11H5N3O5S MolecularWeight: 291.2395

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])N3C(=C(C=NC3=O)C(=O)O)S2

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])N3C(=C(C=NC3=O)C(=O)O)S2

InChI

InChI=1S/C11H5N3O5S/c15-10(16)6-4-12-11(17)13-7-3-5(14(18)19)1-2-8(7)20-9(6)13/h1-4H,(H,15,16)