2-[[methyl(octadecyl)amino]methyl]prop-2-enenitrile; propanoic acid

Systemtic Name: 2-[[methyl(octadecyl)amino]methyl]prop-2-enenitrile; propanoic acid Openeye Name: 2-[[methyl(octadecyl)amino]methyl]prop-2-enenitrile; propionic acid CAS Name: 2-[[methyl(octadecyl)amino]methyl]-2-propenenitrile; propanoic acid IUPAC Name: 2-[[methyl(octadecyl)amino]methyl]prop-2-enenitrile; propanoic acid Traditional Name: 2-[[methyl(stearyl)amino]methyl]acrylonitrile; propionic acid Formula: C26H50N2O2 MolecularWeight: 422.6874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C)CC(=C)C#N.CCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C)CC(=C)C#N.CCC(=O)O

InChI

InChI=1S/C23H44N2.C3H6O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(3)22-23(2)21-24;1-2-3(4)5/h2,4-20,22H2,1,3H3;2H2,1H3,(H,4,5)