(2S)-2-azanyl-N-(2-dodecoxy-3-octadecoxy-propyl)-3-(1H-imidazol-5-yl)propanamide

Systemtic Name: (2S)-2-azanyl-N-(2-dodecoxy-3-octadecoxy-propyl)-3-(1H-imidazol-5-yl)propanamide Openeye Name: (2S)-2-amino-N-(2-dodecoxy-3-octadecoxy-propyl)-3-(1H-imidazol-5-yl)propanamide CAS Name: (2S)-2-amino-N-(2-dodecoxy-3-octadecoxypropyl)-3-(1H-imidazol-5-yl)propanamide IUPAC Name: (2S)-2-amino-N-(2-dodecoxy-3-octadecoxypropyl)-3-(1H-imidazol-5-yl)propanamide Traditional Name: (2S)-2-amino-3-(1H-imidazol-5-yl)-N-(2-lauryloxy-3-stearyloxy-propyl)propionamide Formula: C39H76N4O3 MolecularWeight: 649.04574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CNC(=O)C(CC1=CN=CN1)N)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CNC(=O)[C@H](CC1=CN=CN1)N)OCCCCCCCCCCCC

InChI

InChI=1S/C39H76N4O3/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-29-45-34-37(33-42-39(44)38(40)31-36-32-41-35-43-36)46-30-28-26-24-22-14-12-10-8-6-4-2/h32,35,37-38H,3-31,33-34,40H2,1-2H3,(H,41,43)(H,42,44)/t37?,38-/m0/s1