(2S)-2-(dodecylamino)-5-(2-octyldodecoxy)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-(dodecylamino)-5-(2-octyldodecoxy)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-(dodecylamino)-5-(2-octyldodecoxy)-5-oxo-pentanoic acid CAS Name: (2S)-2-(dodecylamino)-5-(2-octyldodecoxy)-5-oxopentanoic acid IUPAC Name: (2S)-2-(dodecylamino)-5-(2-octyldodecoxy)-5-oxopentanoic acid Traditional Name: (2S)-5-keto-2-(laurylamino)-5-(2-octyldodecoxy)valeric acid Formula: C37H73NO4 MolecularWeight: 595.97982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(CCC(=O)OCC(CCCCCCCC)CCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCN[C@@H](CCC(=O)OCC(CCCCCCCC)CCCCCCCCCC)C(=O)O

InChI

InChI=1S/C37H73NO4/c1-4-7-10-13-16-18-19-21-24-27-32-38-35(37(40)41)30-31-36(39)42-33-34(28-25-22-15-12-9-6-3)29-26-23-20-17-14-11-8-5-2/h34-35,38H,4-33H2,1-3H3,(H,40,41)/t34?,35-/m0/s1