2-[6-[2,4-bis(chloranyl)-6-phenyl-phenyl]hexylsulfanylmethyl]-2-oxidanyl-butanedioic acid

Systemtic Name: 2-[6-[2,4-bis(chloranyl)-6-phenyl-phenyl]hexylsulfanylmethyl]-2-oxidanyl-butanedioic acid Openeye Name: 2-[6-(2,4-dichloro-6-phenyl-phenyl)hexylsulfanylmethyl]-2-hydroxy-butanedioic acid CAS Name: 2-[[6-(2,4-dichloro-6-phenylphenyl)hexylthio]methyl]-2-hydroxybutanedioic acid IUPAC Name: 2-[6-(2,4-dichloro-6-phenylphenyl)hexylsulfanylmethyl]-2-hydroxybutanedioic acid Traditional Name: 2-[[6-(2,4-dichloro-6-phenyl-phenyl)hexylthio]methyl]-2-hydroxy-succinic acid Formula: C23H26Cl2O5S MolecularWeight: 485.42054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC(=C2CCCCCCSCC(CC(=O)O)(C(=O)O)O)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC(=C2CCCCCCSCC(CC(=O)O)(C(=O)O)O)Cl)Cl

InChI

InChI=1S/C23H26Cl2O5S/c24-17-12-19(16-8-4-3-5-9-16)18(20(25)13-17)10-6-1-2-7-11-31-15-23(30,22(28)29)14-21(26)27/h3-5,8-9,12-13,30H,1-2,6-7,10-11,14-15H2,(H,26,27)(H,28,29)