4-chloranyl-5-(4,5-dicarboxy-2-chloranyl-cyclohexyl)sulfonyl-cyclohexane-1,2-dicarboxylic acid

Systemtic Name: 4-chloranyl-5-(4,5-dicarboxy-2-chloranyl-cyclohexyl)sulfonyl-cyclohexane-1,2-dicarboxylic acid Openeye Name: 4-chloro-5-(4,5-dicarboxy-2-chloro-cyclohexyl)sulfonyl-cyclohexane-1,2-dicarboxylic acid CAS Name: 4-chloro-5-(4,5-dicarboxy-2-chlorocyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid IUPAC Name: 4-chloro-5-(4,5-dicarboxy-2-chlorocyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid Traditional Name: 4-chloro-5-(4,5-dicarboxy-2-chloro-cyclohexyl)sulfonyl-cyclohexane-1,2-dicarboxylic acid Formula: C16H20Cl2O10S MolecularWeight: 475.295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CC(C1S(=O)(=O)C2CC(C(CC2Cl)C(=O)O)C(=O)O)Cl)C(=O)O)C(=O)O

Isomeric SMILES

C1C(C(CC(C1S(=O)(=O)C2CC(C(CC2Cl)C(=O)O)C(=O)O)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C16H20Cl2O10S/c17-9-1-5(13(19)20)7(15(23)24)3-11(9)29(27,28)12-4-8(16(25)26)6(14(21)22)2-10(12)18/h5-12H,1-4H2,(H,19,20)(H,21,22)(H,23,24)(H,25,26)