1-[[2-[[2-(1-dodecanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl dodecanoate

Systemtic Name: 1-[[2-[[2-(1-dodecanoyloxypropylcarbamoyl)phenyl]disulfanyl]phenyl]carbonylamino]propyl dodecanoate Openeye Name: 1-[[2-[[2-(1-dodecanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl dodecanoate CAS Name: dodecanoic acid 1-[[oxo-[2-[[2-[oxo-[1-(1-oxododecoxy)propylamino]methyl]phenyl]disulfanyl]phenyl]methyl]amino]propyl ester IUPAC Name: 1-[[2-[[2-(1-dodecanoyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl dodecanoate Traditional Name: lauric acid 1-[[2-[[2-(1-lauroyloxypropylcarbamoyl)phenyl]disulfanyl]benzoyl]amino]propyl ester Formula: C44H68N2O6S2 MolecularWeight: 785.15052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(CC)NC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NC(CC)OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(CC)NC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NC(CC)OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C44H68N2O6S2/c1-5-9-11-13-15-17-19-21-23-33-41(47)51-39(7-3)45-43(49)35-29-25-27-31-37(35)53-54-38-32-28-26-30-36(38)44(50)46-40(8-4)52-42(48)34-24-22-20-18-16-14-12-10-6-2/h25-32,39-40H,5-24,33-34H2,1-4H3,(H,45,49)(H,46,50)