2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-pentanoic acid

Systemtic Name: 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-pentanoic acid Openeye Name: 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-pentanoic acid CAS Name: 2-[(3,5-ditert-butylphenyl)thio]-2-methylpentanoic acid IUPAC Name: 2-(3,5-ditert-butylphenyl)sulfanyl-2-methylpentanoic acid Traditional Name: 2-[(3,5-ditert-butylphenyl)thio]-2-methyl-valeric acid Formula: C20H32O2S MolecularWeight: 336.53188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)SC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCC(C)(C(=O)O)SC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C20H32O2S/c1-9-10-20(8,17(21)22)23-16-12-14(18(2,3)4)11-15(13-16)19(5,6)7/h11-13H,9-10H2,1-8H3,(H,21,22)