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

Systemtic Name: N-(3-chlorophenyl)-6-nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-(3-chlorophenyl)-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-(3-chlorophenyl)-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-(3-chlorophenyl)-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: (3-chlorophenyl)-(1,1-diketo-6-nitro-1,2-benzothiazol-3-yl)amine Formula: C13H8ClN3O4S MolecularWeight: 337.73832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8ClN3O4S/c14-8-2-1-3-9(6-8)15-13-11-5-4-10(17(18)19)7-12(11)22(20,21)16-13/h1-7H,(H,15,16)