2-[2,2-bis(chloranyl)-4-methanoyl-hexyl]-2-methyl-butanedioic acid

Systemtic Name: 2-[2,2-bis(chloranyl)-4-methanoyl-hexyl]-2-methyl-butanedioic acid Openeye Name: 2-(2,2-dichloro-4-formyl-hexyl)-2-methyl-butanedioic acid CAS Name: 2-(2,2-dichloro-4-formylhexyl)-2-methylbutanedioic acid IUPAC Name: 2-(2,2-dichloro-4-formylhexyl)-2-methylbutanedioic acid Traditional Name: 2-(2,2-dichloro-4-formyl-hexyl)-2-methyl-succinic acid Formula: C12H18Cl2O5 MolecularWeight: 313.17432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC(C)(CC(=O)O)C(=O)O)(Cl)Cl)C=O

Isomeric SMILES

CCC(CC(CC(C)(CC(=O)O)C(=O)O)(Cl)Cl)C=O

InChI

InChI=1S/C12H18Cl2O5/c1-3-8(6-15)4-12(13,14)7-11(2,10(18)19)5-9(16)17/h6,8H,3-5,7H2,1-2H3,(H,16,17)(H,18,19)