2-[11-(7-dodecylsulfanylheptanoylamino)undecanoylamino]ethanoic acid

Systemtic Name: 2-[11-(7-dodecylsulfanylheptanoylamino)undecanoylamino]ethanoic acid Openeye Name: 2-[11-(7-dodecylsulfanylheptanoylamino)undecanoylamino]acetic acid CAS Name: 2-[[11-[[7-(dodecylthio)-1-oxoheptyl]amino]-1-oxoundecyl]amino]acetic acid IUPAC Name: 2-[11-(7-dodecylsulfanylheptanoylamino)undecanoylamino]acetic acid Traditional Name: 2-[11-[7-(laurylthio)heptanoylamino]undecanoylamino]acetic acid Formula: C32H62N2O4S MolecularWeight: 570.91068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCCCCCC(=O)NCCCCCCCCCCC(=O)NCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCSCCCCCCC(=O)NCCCCCCCCCCC(=O)NCC(=O)O

InChI

InChI=1S/C32H62N2O4S/c1-2-3-4-5-6-7-10-13-17-22-27-39-28-23-18-15-20-24-30(35)33-26-21-16-12-9-8-11-14-19-25-31(36)34-29-32(37)38/h2-29H2,1H3,(H,33,35)(H,34,36)(H,37,38)