2-(3,3-dimethylbutoxy)-6-(2-sulfanylethyl)benzoic acid

Systemtic Name: 2-(3,3-dimethylbutoxy)-6-(2-sulfanylethyl)benzoic acid Openeye Name: 2-(3,3-dimethylbutoxy)-6-(2-sulfanylethyl)benzoic acid CAS Name: 2-(3,3-dimethylbutoxy)-6-(2-mercaptoethyl)benzoic acid IUPAC Name: 2-(3,3-dimethylbutoxy)-6-(2-sulfanylethyl)benzoic acid Traditional Name: 2-(3,3-dimethylbutoxy)-6-(2-mercaptoethyl)benzoic acid Formula: C15H22O3S MolecularWeight: 282.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCOC1=CC=CC(=C1C(=O)O)CCS

Isomeric SMILES

CC(C)(C)CCOC1=CC=CC(=C1C(=O)O)CCS

InChI

InChI=1S/C15H22O3S/c1-15(2,3)8-9-18-12-6-4-5-11(7-10-19)13(12)14(16)17/h4-6,19H,7-10H2,1-3H3,(H,16,17)