2-[1-(carboxymethylsulfanyl)-3-(3,5-dimethyl-4-oxidanyl-phenyl)-2,2-dimethyl-propyl]sulfanylethanoic acid

Systemtic Name: 2-[1-(carboxymethylsulfanyl)-3-(3,5-dimethyl-4-oxidanyl-phenyl)-2,2-dimethyl-propyl]sulfanylethanoic acid Openeye Name: 2-[1-(carboxymethylsulfanyl)-3-(4-hydroxy-3,5-dimethyl-phenyl)-2,2-dimethyl-propyl]sulfanylacetic acid CAS Name: 2-[[1-(carboxymethylthio)-3-(4-hydroxy-3,5-dimethylphenyl)-2,2-dimethylpropyl]thio]acetic acid IUPAC Name: 2-[1-(carboxymethylsulfanyl)-3-(4-hydroxy-3,5-dimethylphenyl)-2,2-dimethylpropyl]sulfanylacetic acid Traditional Name: 2-[[1-(carboxymethylthio)-3-(4-hydroxy-3,5-dimethyl-phenyl)-2,2-dimethyl-propyl]thio]acetic acid Formula: C17H24O5S2 MolecularWeight: 372.49946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CC(C)(C)C(SCC(=O)O)SCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CC(C)(C)C(SCC(=O)O)SCC(=O)O

InChI

InChI=1S/C17H24O5S2/c1-10-5-12(6-11(2)15(10)22)7-17(3,4)16(23-8-13(18)19)24-9-14(20)21/h5-6,16,22H,7-9H2,1-4H3,(H,18,19)(H,20,21)