2-[2-(4-tert-butylphenyl)sulfanylethoxy]benzoic acid

Systemtic Name: 2-[2-(4-tert-butylphenyl)sulfanylethoxy]benzoic acid Openeye Name: 2-[2-(4-tert-butylphenyl)sulfanylethoxy]benzoic acid CAS Name: 2-[2-[(4-tert-butylphenyl)thio]ethoxy]benzoic acid IUPAC Name: 2-[2-(4-tert-butylphenyl)sulfanylethoxy]benzoic acid Traditional Name: 2-[2-[(4-tert-butylphenyl)thio]ethoxy]benzoic acid Formula: C19H22O3S MolecularWeight: 330.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCCOC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCCOC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H22O3S/c1-19(2,3)14-8-10-15(11-9-14)23-13-12-22-17-7-5-4-6-16(17)18(20)21/h4-11H,12-13H2,1-3H3,(H,20,21)