2-[2-(3,5-dimethylphenyl)sulfanylethoxy]benzoate

Systemtic Name: 2-[2-(3,5-dimethylphenyl)sulfanylethoxy]benzoate Openeye Name: 2-[2-(3,5-dimethylphenyl)sulfanylethoxy]benzoate CAS Name: 2-[2-[(3,5-dimethylphenyl)thio]ethoxy]benzoate IUPAC Name: 2-[2-(3,5-dimethylphenyl)sulfanylethoxy]benzoate Traditional Name: 2-[2-[(3,5-dimethylphenyl)thio]ethoxy]benzoate Formula: C17H17O3S- MolecularWeight: 301.38008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SCCOC2=CC=CC=C2C(=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)SCCOC2=CC=CC=C2C(=O)[O-])C

InChI

InChI=1S/C17H18O3S/c1-12-9-13(2)11-14(10-12)21-8-7-20-16-6-4-3-5-15(16)17(18)19/h3-6,9-11H,7-8H2,1-2H3,(H,18,19)/p-1