2-[11-[7-dodecylsulfanylheptanoyl(ethyl)amino]undecanoylamino]ethanoic acid

Systemtic Name: 2-[11-[7-dodecylsulfanylheptanoyl(ethyl)amino]undecanoylamino]ethanoic acid Openeye Name: 2-[11-[7-dodecylsulfanylheptanoyl(ethyl)amino]undecanoylamino]acetic acid CAS Name: 2-[[11-[[7-(dodecylthio)-1-oxoheptyl]-ethylamino]-1-oxoundecyl]amino]acetic acid IUPAC Name: 2-[11-[7-dodecylsulfanylheptanoyl(ethyl)amino]undecanoylamino]acetic acid Traditional Name: 2-[11-[ethyl-[7-(laurylthio)heptanoyl]amino]undecanoylamino]acetic acid Formula: C34H66N2O4S MolecularWeight: 598.96384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCCCCCC(=O)N(CC)CCCCCCCCCCC(=O)NCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCSCCCCCCC(=O)N(CC)CCCCCCCCCCC(=O)NCC(=O)O

InChI

InChI=1S/C34H66N2O4S/c1-3-5-6-7-8-9-12-15-19-24-29-41-30-25-20-17-22-27-33(38)36(4-2)28-23-18-14-11-10-13-16-21-26-32(37)35-31-34(39)40/h3-31H2,1-2H3,(H,35,37)(H,39,40)