2-(2-hydroxyethyl)butanedinitrile; propane-1,2,3-triol

Systemtic Name: 2-(2-hydroxyethyl)butanedinitrile; propane-1,2,3-triol Openeye Name: glycerol; 2-(2-hydroxyethyl)butanedinitrile CAS Name: 2-(2-hydroxyethyl)butanedinitrile; propane-1,2,3-triol IUPAC Name: 2-(2-hydroxyethyl)butanedinitrile; propane-1,2,3-triol Traditional Name: glycerol; 2-(2-hydroxyethyl)succinonitrile Formula: C9H16N2O4 MolecularWeight: 216.23434

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)C(CC#N)C#N.C(C(CO)O)O

Isomeric SMILES

C(CO)C(CC#N)C#N.C(C(CO)O)O

InChI

InChI=1S/C6H8N2O.C3H8O3/c7-3-1-6(5-8)2-4-9;4-1-3(6)2-5/h6,9H,1-2,4H2;3-6H,1-2H2