2-cyanoethyl (4,4-dimethyl-2-oxidanylidene-oxolan-3-yl) hydrogen phosphate

Systemtic Name: 2-cyanoethyl (4,4-dimethyl-2-oxidanylidene-oxolan-3-yl) hydrogen phosphate Openeye Name: 2-cyanoethyl (4,4-dimethyl-2-oxo-tetrahydrofuran-3-yl) hydrogen phosphate CAS Name: 2-cyanoethyl (4,4-dimethyl-2-oxo-3-oxolanyl) hydrogen phosphate IUPAC Name: 2-cyanoethyl (4,4-dimethyl-2-oxooxolan-3-yl) hydrogen phosphate Traditional Name: 2-cyanoethyl (2-keto-4,4-dimethyl-tetrahydrofuran-3-yl) hydrogen phosphate Formula: C9H14NO6P MolecularWeight: 263.184321

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=O)C1OP(=O)(O)OCCC#N)C

Isomeric SMILES

CC1(COC(=O)C1OP(=O)(O)OCCC#N)C

InChI

InChI=1S/C9H14NO6P/c1-9(2)6-14-8(11)7(9)16-17(12,13)15-5-3-4-10/h7H,3,5-6H2,1-2H3,(H,12,13)