12,13-bis(hydroxymethyl)octadecanenitrile

Systemtic Name: 12,13-bis(hydroxymethyl)octadecanenitrile Openeye Name: 12,13-bis(hydroxymethyl)octadecanenitrile CAS Name: 12,13-bis(hydroxymethyl)octadecanenitrile IUPAC Name: 12,13-bis(hydroxymethyl)octadecanenitrile Traditional Name: 12,13-dimethylolstearonitrile Formula: C20H39NO2 MolecularWeight: 325.52916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CO)C(CCCCCCCCCCC#N)CO

Isomeric SMILES

CCCCCC(CO)C(CCCCCCCCCCC#N)CO

InChI

InChI=1S/C20H39NO2/c1-2-3-11-14-19(17-22)20(18-23)15-12-9-7-5-4-6-8-10-13-16-21/h19-20,22-23H,2-15,17-18H2,1H3