2-oxidanyl-2-[6-[2-(phenylmethyl)phenyl]hexylsulfanylmethyl]butanedioic acid

Systemtic Name: 2-oxidanyl-2-[6-[2-(phenylmethyl)phenyl]hexylsulfanylmethyl]butanedioic acid Openeye Name: 2-[6-(2-benzylphenyl)hexylsulfanylmethyl]-2-hydroxy-butanedioic acid CAS Name: 2-hydroxy-2-[[6-[2-(phenylmethyl)phenyl]hexylthio]methyl]butanedioic acid IUPAC Name: 2-[6-(2-benzylphenyl)hexylsulfanylmethyl]-2-hydroxybutanedioic acid Traditional Name: 2-[[6-(2-benzylphenyl)hexylthio]methyl]-2-hydroxy-succinic acid Formula: C24H30O5S MolecularWeight: 430.557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2CCCCCCSCC(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2CCCCCCSCC(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C24H30O5S/c25-22(26)17-24(29,23(27)28)18-30-15-9-2-1-6-12-20-13-7-8-14-21(20)16-19-10-4-3-5-11-19/h3-5,7-8,10-11,13-14,29H,1-2,6,9,12,15-18H2,(H,25,26)(H,27,28)