2-(4-methylcyclohexyl)-2-(2-oxidanylideneethyl)propanedioic acid

Systemtic Name: 2-(4-methylcyclohexyl)-2-(2-oxidanylideneethyl)propanedioic acid Openeye Name: 2-(4-methylcyclohexyl)-2-(2-oxoethyl)propanedioic acid CAS Name: 2-(4-methylcyclohexyl)-2-(2-oxoethyl)propanedioic acid IUPAC Name: 2-(4-methylcyclohexyl)-2-(2-oxoethyl)propanedioic acid Traditional Name: 2-(2-ketoethyl)-2-(4-methylcyclohexyl)malonic acid Formula: C12H18O5 MolecularWeight: 242.26832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(CC=O)(C(=O)O)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(CC=O)(C(=O)O)C(=O)O

InChI

InChI=1S/C12H18O5/c1-8-2-4-9(5-3-8)12(6-7-13,10(14)15)11(16)17/h7-9H,2-6H2,1H3,(H,14,15)(H,16,17)