6-nitro-1,1-bis(oxidanylidene)-2-pyridin-4-yl-1,2-benzothiazol-3-one

Systemtic Name: 6-nitro-1,1-bis(oxidanylidene)-2-pyridin-4-yl-1,2-benzothiazol-3-one Openeye Name: 6-nitro-1,1-dioxo-2-(4-pyridyl)-1,2-benzothiazol-3-one CAS Name: 6-nitro-1,1-dioxo-2-pyridin-4-yl-1,2-benzothiazol-3-one IUPAC Name: 6-nitro-1,1-dioxo-2-pyridin-4-yl-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-6-nitro-2-(4-pyridyl)-1,2-benzothiazol-3-one Formula: C12H7N3O5S MolecularWeight: 305.26608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)N(C2=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)N(C2=O)C3=CC=NC=C3

InChI

InChI=1S/C12H7N3O5S/c16-12-10-2-1-9(15(17)18)7-11(10)21(19,20)14(12)8-3-5-13-6-4-8/h1-7H