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4-[2-(11-ethylsulfanylundecanoylamino)phenyl]sulfanylbutanoic acid

4-[2-(11-ethylsulfanylundecanoylamino)phenyl]sulfanylbutanoic acid

Systemtic Name:4-[2-(11-ethylsulfanylundecanoylamino)phenyl]sulfanylbutanoic acid
Openeye Name:4-[2-(11-ethylsulfanylundecanoylamino)phenyl]sulfanylbutanoic acid
CAS Name:4-[[2-[[11-(ethylthio)-1-oxoundecyl]amino]phenyl]thio]butanoic acid
IUPAC Name:4-[2-(11-ethylsulfanylundecanoylamino)phenyl]sulfanylbutanoic acid
Traditional Name:4-[[2-[11-(ethylthio)undecanoylamino]phenyl]thio]butyric acid
Formula: C23H37NO3S2
MolecularWeight: 439.67478
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Descriptors Computed from Structure

Canonical SMILES:

CCSCCCCCCCCCCC(=O)NC1=CC=CC=C1SCCCC(=O)O


Isomeric SMILES

CCSCCCCCCCCCCC(=O)NC1=CC=CC=C1SCCCC(=O)O


InChI

InChI=1S/C23H37NO3S2/c1-2-28-18-12-8-6-4-3-5-7-9-16-22(25)24-20-14-10-11-15-21(20)29-19-13-17-23(26)27/h10-11,14-15H,2-9,12-13,16-19H2,1H3,(H,24,25)(H,26,27)


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