2-[bis(dimethoxyphosphoryl)methylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[bis(dimethoxyphosphoryl)methylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[bis(dimethoxyphosphoryl)methylsulfanyl]-1,3-benzoxazole CAS Name: 2-[bis(dimethoxyphosphoryl)methylthio]-1,3-benzoxazole IUPAC Name: 2-[bis(dimethoxyphosphoryl)methylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[bis(dimethoxyphosphoryl)methylthio]-1,3-benzoxazole Formula: C12H17NO7P2S MolecularWeight: 381.278402

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C(P(=O)(OC)OC)SC1=NC2=CC=CC=C2O1)OC

Isomeric SMILES

COP(=O)(C(P(=O)(OC)OC)SC1=NC2=CC=CC=C2O1)OC

InChI

InChI=1S/C12H17NO7P2S/c1-16-21(14,17-2)12(22(15,18-3)19-4)23-11-13-9-7-5-6-8-10(9)20-11/h5-8,12H,1-4H3