(2S)-6-(dimethylamino)-2-(hexadecanoylamino)hexanoic acid

Systemtic Name: (2S)-6-(dimethylamino)-2-(hexadecanoylamino)hexanoic acid Openeye Name: (2S)-6-(dimethylamino)-2-(hexadecanoylamino)hexanoic acid CAS Name: (2S)-6-(dimethylamino)-2-(1-oxohexadecylamino)hexanoic acid IUPAC Name: (2S)-6-(dimethylamino)-2-(hexadecanoylamino)hexanoic acid Traditional Name: (2S)-6-(dimethylamino)-2-palmitamido-hexanoic acid Formula: C24H48N2O3 MolecularWeight: 412.64952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CCCCN(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN(C)C)C(=O)O

InChI

InChI=1S/C24H48N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23(27)25-22(24(28)29)19-17-18-21-26(2)3/h22H,4-21H2,1-3H3,(H,25,27)(H,28,29)/t22-/m0/s1