2,6-bis(azanyl)hexanoic acid; 2-(hexadecanoylamino)propanoic acid

Systemtic Name: 2,6-bis(azanyl)hexanoic acid; 2-(hexadecanoylamino)propanoic acid Openeye Name: 2,6-diaminohexanoic acid; 2-(hexadecanoylamino)propanoic acid CAS Name: 2,6-diaminohexanoic acid; 2-(1-oxohexadecylamino)propanoic acid IUPAC Name: 2,6-diaminohexanoic acid; 2-(hexadecanoylamino)propanoic acid Traditional Name: 2,6-diaminohexanoic acid; 2-palmitamidopropionic acid Formula: C25H51N3O5 MolecularWeight: 473.68954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(C)C(=O)O.C(CCN)CC(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(C)C(=O)O.C(CCN)CC(C(=O)O)N

InChI

InChI=1S/C19H37NO3.C6H14N2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(21)20-17(2)19(22)23;7-4-2-1-3-5(8)6(9)10/h17H,3-16H2,1-2H3,(H,20,21)(H,22,23);5H,1-4,7-8H2,(H,9,10)