3-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-2,4-bis(chloranyl)-3-(1-chloranyl-2-oxidanyl-2-oxidanylidene-ethyl)pentanedioic acid

Systemtic Name: 3-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-2,4-bis(chloranyl)-3-(1-chloranyl-2-oxidanyl-2-oxidanylidene-ethyl)pentanedioic acid Openeye Name: 2,4-dichloro-3-(1-chloro-2-hydroxy-2-oxo-ethyl)-3-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]pentanedioic acid CAS Name: 2,4-dichloro-3-(1-chloro-2-hydroxy-2-oxoethyl)-3-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]pentanedioic acid IUPAC Name: 2,4-dichloro-3-(1-chloro-2-hydroxy-2-oxoethyl)-3-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]pentanedioic acid Traditional Name: 2,4-dichloro-3-(1-chloro-2-hydroxy-2-keto-ethyl)-3-(3-hydroxy-2,2-dimethylol-propyl)glutaric acid Formula: C12H17Cl3O9 MolecularWeight: 411.61698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(CO)(CO)CO)C(C(C(=O)O)Cl)(C(C(=O)O)Cl)C(C(=O)O)Cl

Isomeric SMILES

C(C(CO)(CO)CO)C(C(C(=O)O)Cl)(C(C(=O)O)Cl)C(C(=O)O)Cl

InChI

InChI=1S/C12H17Cl3O9/c13-5(8(19)20)12(6(14)9(21)22,7(15)10(23)24)1-11(2-16,3-17)4-18/h5-7,16-18H,1-4H2,(H,19,20)(H,21,22)(H,23,24)