N-(1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide Formula: C13H9N3O4S2 MolecularWeight: 335.35826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O4S2/c17-16(18)9-4-3-5-10(8-9)22(19,20)15-13-14-11-6-1-2-7-12(11)21-13/h1-8H,(H,14,15)