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2-oxidanyl-3-[2-(8-phenyloctyl)phenyl]-3-sulfanyl-propanoic acid

2-oxidanyl-3-[2-(8-phenyloctyl)phenyl]-3-sulfanyl-propanoic acid

Systemtic Name:2-oxidanyl-3-[2-(8-phenyloctyl)phenyl]-3-sulfanyl-propanoic acid
Openeye Name:2-hydroxy-3-[2-(8-phenyloctyl)phenyl]-3-sulfanyl-propanoic acid
CAS Name:2-hydroxy-3-mercapto-3-[2-(8-phenyloctyl)phenyl]propanoic acid
IUPAC Name:2-hydroxy-3-[2-(8-phenyloctyl)phenyl]-3-sulfanylpropanoic acid
Traditional Name:2-hydroxy-3-mercapto-3-[2-(8-phenyloctyl)phenyl]propionic acid
Formula: C23H30O3S
MolecularWeight: 386.5475
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC=C2C(C(C(=O)O)O)S


Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC=C2C(C(C(=O)O)O)S


InChI

InChI=1S/C23H30O3S/c24-21(23(25)26)22(27)20-17-11-10-16-19(20)15-9-4-2-1-3-6-12-18-13-7-5-8-14-18/h5,7-8,10-11,13-14,16-17,21-22,24,27H,1-4,6,9,12,15H2,(H,25,26)


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