2-[8-(2,4-dichlorophenyl)-2-oxidanyl-octyl]-2-oxidanyl-butanedioic acid

Systemtic Name: 2-[8-(2,4-dichlorophenyl)-2-oxidanyl-octyl]-2-oxidanyl-butanedioic acid Openeye Name: 2-[8-(2,4-dichlorophenyl)-2-hydroxy-octyl]-2-hydroxy-butanedioic acid CAS Name: 2-[8-(2,4-dichlorophenyl)-2-hydroxyoctyl]-2-hydroxybutanedioic acid IUPAC Name: 2-[8-(2,4-dichlorophenyl)-2-hydroxyoctyl]-2-hydroxybutanedioic acid Traditional Name: 2-[8-(2,4-dichlorophenyl)-2-hydroxy-octyl]-2-hydroxy-succinic acid Formula: C18H24Cl2O6 MolecularWeight: 407.28556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CCCCCCC(CC(CC(=O)O)(C(=O)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CCCCCCC(CC(CC(=O)O)(C(=O)O)O)O

InChI

InChI=1S/C18H24Cl2O6/c19-13-8-7-12(15(20)9-13)5-3-1-2-4-6-14(21)10-18(26,17(24)25)11-16(22)23/h7-9,14,21,26H,1-6,10-11H2,(H,22,23)(H,24,25)