3-[2-(2,4-dimethylphenyl)sulfanylethoxy]benzoate

Systemtic Name: 3-[2-(2,4-dimethylphenyl)sulfanylethoxy]benzoate Openeye Name: 3-[2-(2,4-dimethylphenyl)sulfanylethoxy]benzoate CAS Name: 3-[2-[(2,4-dimethylphenyl)thio]ethoxy]benzoate IUPAC Name: 3-[2-(2,4-dimethylphenyl)sulfanylethoxy]benzoate Traditional Name: 3-[2-[(2,4-dimethylphenyl)thio]ethoxy]benzoate Formula: C17H17O3S- MolecularWeight: 301.38008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCCOC2=CC=CC(=C2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)SCCOC2=CC=CC(=C2)C(=O)[O-])C

InChI

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