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1-cyanoethyl phosphate; 1,2-dioxetane

1-cyanoethyl phosphate; 1,2-dioxetane

Systemtic Name:1-cyanoethyl phosphate; 1,2-dioxetane
Openeye Name:1-cyanoethyl phosphate; dioxetane
CAS Name:1-cyanoethyl phosphate; dioxetane
IUPAC Name:1-cyanoethyl phosphate; dioxetane
Traditional Name:1-cyanoethyl phosphate; dioxetane
Formula: C5H8NO6P-2
MolecularWeight: 209.093881
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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OP(=O)([O-])[O-].C1COO1


Isomeric SMILES

CC(C#N)OP(=O)([O-])[O-].C1COO1


InChI

InChI=1S/C3H6NO4P.C2H4O2/c1-3(2-4)8-9(5,6)7;1-2-4-3-1/h3H,1H3,(H2,5,6,7);1-2H2/p-2


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