2,2,2-tris(chloranyl)-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2,2,2-tris(chloranyl)-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2,2,2-trichloro-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2,2,2-trichloro-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2,2,2-trichloro-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2,2,2-trichloro-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C9H4Cl3N3O3S MolecularWeight: 340.57036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C9H4Cl3N3O3S/c10-9(11,12)7(16)14-8-13-5-2-1-4(15(17)18)3-6(5)19-8/h1-3H,(H,13,14,16)