3-chloranyl-N-dimethoxyphosphoryl-6-nitro-1,2-benzothiazol-4-amine

Systemtic Name: 3-chloranyl-N-dimethoxyphosphoryl-6-nitro-1,2-benzothiazol-4-amine Openeye Name: 3-chloro-N-dimethoxyphosphoryl-6-nitro-1,2-benzothiazol-4-amine CAS Name: 3-chloro-N-dimethoxyphosphoryl-6-nitro-1,2-benzothiazol-4-amine IUPAC Name: 3-chloro-N-dimethoxyphosphoryl-6-nitro-1,2-benzothiazol-4-amine Traditional Name: (3-chloro-6-nitro-1,2-benzothiazol-4-yl)-dimethoxyphosphoryl-amine Formula: C9H9ClN3O5PS MolecularWeight: 337.676621

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(NC1=CC(=CC2=C1C(=NS2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COP(=O)(NC1=CC(=CC2=C1C(=NS2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C9H9ClN3O5PS/c1-17-19(16,18-2)11-6-3-5(13(14)15)4-7-8(6)9(10)12-20-7/h3-4H,1-2H3,(H,11,16)