(5-cyano-2,2-dimethyl-1-oxidanyl-4-oxidanylidene-pentan-3-yl) 2-cyanoethanoate

Systemtic Name: (5-cyano-2,2-dimethyl-1-oxidanyl-4-oxidanylidene-pentan-3-yl) 2-cyanoethanoate Openeye Name: [1-(2-cyanoacetyl)-3-hydroxy-2,2-dimethyl-propyl] 2-cyanoacetate CAS Name: 2-cyanoacetic acid (5-cyano-1-hydroxy-2,2-dimethyl-4-oxopentan-3-yl) ester IUPAC Name: (5-cyano-1-hydroxy-2,2-dimethyl-4-oxopentan-3-yl) 2-cyanoacetate Traditional Name: 2-cyanoacetic acid [1-(2-cyanoacetyl)-3-hydroxy-2,2-dimethyl-propyl] ester Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C(C(=O)CC#N)OC(=O)CC#N

Isomeric SMILES

CC(C)(CO)C(C(=O)CC#N)OC(=O)CC#N

InChI

InChI=1S/C11H14N2O4/c1-11(2,7-14)10(8(15)3-5-12)17-9(16)4-6-13/h10,14H,3-4,7H2,1-2H3