5-(4-tert-butylphenyl)sulfanylpentanoic acid

Systemtic Name: 5-(4-tert-butylphenyl)sulfanylpentanoic acid Openeye Name: 5-(4-tert-butylphenyl)sulfanylpentanoic acid CAS Name: 5-[(4-tert-butylphenyl)thio]pentanoic acid IUPAC Name: 5-(4-tert-butylphenyl)sulfanylpentanoic acid Traditional Name: 5-[(4-tert-butylphenyl)thio]valeric acid Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCCCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCCCCC(=O)O

InChI

InChI=1S/C15H22O2S/c1-15(2,3)12-7-9-13(10-8-12)18-11-5-4-6-14(16)17/h7-10H,4-6,11H2,1-3H3,(H,16,17)