1-[2-(dodecylsulfonylamino)-3-oxidanyl-propoxy]deca-5,7,9-triyn-3-yl dodecanoate

Systemtic Name: 1-[2-(dodecylsulfonylamino)-3-oxidanyl-propoxy]deca-5,7,9-triyn-3-yl dodecanoate Openeye Name: 1-[2-[2-(dodecylsulfonylamino)-3-hydroxy-propoxy]ethyl]octa-3,5,7-triynyl dodecanoate CAS Name: dodecanoic acid 1-[2-(dodecylsulfonylamino)-3-hydroxypropoxy]deca-5,7,9-triyn-3-yl ester IUPAC Name: 1-[2-(dodecylsulfonylamino)-3-hydroxypropoxy]deca-5,7,9-triyn-3-yl dodecanoate Traditional Name: lauric acid 1-[2-[3-hydroxy-2-(laurylsulfonylamino)propoxy]ethyl]octa-3,5,7-triynyl ester Formula: C37H63NO6S MolecularWeight: 649.96422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)NC(CO)COCCC(CC#CC#CC#C)OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)NC(CO)COCCC(CC#CC#CC#C)OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C37H63NO6S/c1-4-7-10-13-15-17-19-21-24-27-32-45(41,42)38-35(33-39)34-43-31-30-36(28-25-22-12-9-6-3)44-37(40)29-26-23-20-18-16-14-11-8-5-2/h3,35-36,38-39H,4-5,7-8,10-11,13-21,23-24,26-34H2,1-2H3