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11-(13-dodecylsulfanyltridecanoylamino)undecanoic acid

11-(13-dodecylsulfanyltridecanoylamino)undecanoic acid

Systemtic Name:11-(13-dodecylsulfanyltridecanoylamino)undecanoic acid
Openeye Name:11-(13-dodecylsulfanyltridecanoylamino)undecanoic acid
CAS Name:11-[[13-(dodecylthio)-1-oxotridecyl]amino]undecanoic acid
IUPAC Name:11-(13-dodecylsulfanyltridecanoylamino)undecanoic acid
Traditional Name:11-[13-(laurylthio)tridecanoylamino]undecanoic acid
Formula: C36H71NO3S
MolecularWeight: 598.01884
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)O


Isomeric SMILES

CCCCCCCCCCCCSCCCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)O


InChI

InChI=1S/C36H71NO3S/c1-2-3-4-5-6-7-13-18-23-28-33-41-34-29-24-19-14-9-8-10-15-20-25-30-35(38)37-32-27-22-17-12-11-16-21-26-31-36(39)40/h2-34H2,1H3,(H,37,38)(H,39,40)


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