(4R,5R,6R)-6-(furan-2-yl)-5-(methoxymethyl)-4-methyl-cycloheptane-1,3-dione

Systemtic Name: (4R,5R,6R)-6-(furan-2-yl)-5-(methoxymethyl)-4-methyl-cycloheptane-1,3-dione Openeye Name: (4R,5R,6R)-6-(2-furyl)-5-(methoxymethyl)-4-methyl-cycloheptane-1,3-dione CAS Name: (4R,5R,6R)-6-(2-furanyl)-5-(methoxymethyl)-4-methylcycloheptane-1,3-dione IUPAC Name: (4R,5R,6R)-6-(furan-2-yl)-5-(methoxymethyl)-4-methylcycloheptane-1,3-dione Traditional Name: (4R,5R,6R)-6-(2-furyl)-5-(methoxymethyl)-4-methyl-cycloheptane-1,3-quinone Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(=O)CC1=O)C2=CC=CO2)COC

Isomeric SMILES

C[C@@H]1[C@@H]([C@@H](CC(=O)CC1=O)C2=CC=CO2)COC

InChI

InChI=1S/C14H18O4/c1-9-12(8-17-2)11(14-4-3-5-18-14)6-10(15)7-13(9)16/h3-5,9,11-12H,6-8H2,1-2H3/t9-,11-,12+/m1/s1