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2-[bis(2,6-dimethylphenyl)methylsulfanyl]ethanoic acid

2-[bis(2,6-dimethylphenyl)methylsulfanyl]ethanoic acid

Systemtic Name:2-[bis(2,6-dimethylphenyl)methylsulfanyl]ethanoic acid
Openeye Name:2-[bis(2,6-dimethylphenyl)methylsulfanyl]acetic acid
CAS Name:2-[bis(2,6-dimethylphenyl)methylthio]acetic acid
IUPAC Name:2-[bis(2,6-dimethylphenyl)methylsulfanyl]acetic acid
Traditional Name:2-[bis(2,6-dimethylphenyl)methylthio]acetic acid
Formula: C19H22O2S
MolecularWeight: 314.44178
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(C2=C(C=CC=C2C)C)SCC(=O)O


Isomeric SMILES

CC1=C(C(=CC=C1)C)C(C2=C(C=CC=C2C)C)SCC(=O)O


InChI

InChI=1S/C19H22O2S/c1-12-7-5-8-13(2)17(12)19(22-11-16(20)21)18-14(3)9-6-10-15(18)4/h5-10,19H,11H2,1-4H3,(H,20,21)


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