2-cyanoethyl bis(1,2,4-triazol-1-yl) phosphate

Systemtic Name: 2-cyanoethyl bis(1,2,4-triazol-1-yl) phosphate Openeye Name: 2-cyanoethyl bis(1,2,4-triazol-1-yl) phosphate CAS Name: phosphoric acid 2-cyanoethyl bis(1,2,4-triazol-1-yl) ester IUPAC Name: 2-cyanoethyl bis(1,2,4-triazol-1-yl) phosphate Traditional Name: phosphoric acid 2-cyanoethyl bis(1,2,4-triazol-1-yl) ester Formula: C7H8N7O4P MolecularWeight: 285.156681

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C=N1)OP(=O)(OCCC#N)ON2C=NC=N2

Isomeric SMILES

C1=NN(C=N1)OP(=O)(OCCC#N)ON2C=NC=N2

InChI

InChI=1S/C7H8N7O4P/c8-2-1-3-16-19(15,17-13-6-9-4-11-13)18-14-7-10-5-12-14/h4-7H,1,3H2