4-(3,4-dicarboxycyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid

Systemtic Name: 4-(3,4-dicarboxycyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid Openeye Name: 4-(3,4-dicarboxycyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid CAS Name: 4-(3,4-dicarboxycyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid IUPAC Name: 4-(3,4-dicarboxycyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid Traditional Name: 4-(3,4-dicarboxycyclohexyl)sulfonylcyclohexane-1,2-dicarboxylic acid Formula: C16H22O10S MolecularWeight: 406.40488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1S(=O)(=O)C2CCC(C(C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(C(CC1S(=O)(=O)C2CCC(C(C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H22O10S/c17-13(18)9-3-1-7(5-11(9)15(21)22)27(25,26)8-2-4-10(14(19)20)12(6-8)16(23)24/h7-12H,1-6H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)