6-nitro-1,1-bis(oxidanylidene)-N-pyridin-3-yl-1,2-benzothiazol-3-amine

Systemtic Name: 6-nitro-1,1-bis(oxidanylidene)-N-pyridin-3-yl-1,2-benzothiazol-3-amine Openeye Name: 6-nitro-1,1-dioxo-N-(3-pyridyl)-1,2-benzothiazol-3-amine CAS Name: 6-nitro-1,1-dioxo-N-(3-pyridinyl)-1,2-benzothiazol-3-amine IUPAC Name: 6-nitro-1,1-dioxo-N-pyridin-3-yl-1,2-benzothiazol-3-amine Traditional Name: (1,1-diketo-6-nitro-1,2-benzothiazol-3-yl)-(3-pyridyl)amine Formula: C12H8N4O4S MolecularWeight: 304.28132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)NC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H8N4O4S/c17-16(18)9-3-4-10-11(6-9)21(19,20)15-12(10)14-8-2-1-5-13-7-8/h1-7H,(H,14,15)