1-oxidanylbutyl 2,2-dicyanopropanoate

Systemtic Name: 1-oxidanylbutyl 2,2-dicyanopropanoate Openeye Name: 1-hydroxybutyl 2,2-dicyanopropanoate CAS Name: 2,2-dicyanopropanoic acid 1-hydroxybutyl ester IUPAC Name: 1-hydroxybutyl 2,2-dicyanopropanoate Traditional Name: 2,2-dicyanopropionic acid 1-hydroxybutyl ester Formula: C9H12N2O3 MolecularWeight: 196.20318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(O)OC(=O)C(C)(C#N)C#N

Isomeric SMILES

CCCC(O)OC(=O)C(C)(C#N)C#N

InChI

InChI=1S/C9H12N2O3/c1-3-4-7(12)14-8(13)9(2,5-10)6-11/h7,12H,3-4H2,1-2H3