2-(cyclohexylmethyl)-2-[2-(furan-2-yl)-2-oxidanylidene-ethyl]propanedioic acid

Systemtic Name: 2-(cyclohexylmethyl)-2-[2-(furan-2-yl)-2-oxidanylidene-ethyl]propanedioic acid Openeye Name: 2-(cyclohexylmethyl)-2-[2-(2-furyl)-2-oxo-ethyl]propanedioic acid CAS Name: 2-(cyclohexylmethyl)-2-[2-(2-furanyl)-2-oxoethyl]propanedioic acid IUPAC Name: 2-(cyclohexylmethyl)-2-[2-(furan-2-yl)-2-oxoethyl]propanedioic acid Traditional Name: 2-(cyclohexylmethyl)-2-[2-(2-furyl)-2-keto-ethyl]malonic acid Formula: C16H20O6 MolecularWeight: 308.3264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)C2=CC=CO2)(C(=O)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)C2=CC=CO2)(C(=O)O)C(=O)O

InChI

InChI=1S/C16H20O6/c17-12(13-7-4-8-22-13)10-16(14(18)19,15(20)21)9-11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10H2,(H,18,19)(H,20,21)