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

Systemtic Name: (4R,5R,6R)-6-(furan-2-yl)-4-methyl-5-(phenylmethoxymethyl)cycloheptane-1,3-dione Openeye Name: (4R,5R,6R)-5-(benzyloxymethyl)-6-(2-furyl)-4-methyl-cycloheptane-1,3-dione CAS Name: (4R,5R,6R)-6-(2-furanyl)-4-methyl-5-(phenylmethoxymethyl)cycloheptane-1,3-dione IUPAC Name: (4R,5R,6R)-6-(furan-2-yl)-4-methyl-5-(phenylmethoxymethyl)cycloheptane-1,3-dione Traditional Name: (4R,5R,6R)-5-(benzoxymethyl)-6-(2-furyl)-4-methyl-cycloheptane-1,3-quinone Formula: C20H22O4 MolecularWeight: 326.38628

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(=O)CC1=O)C2=CC=CO2)COCC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@@H]([C@@H](CC(=O)CC1=O)C2=CC=CO2)COCC3=CC=CC=C3

InChI

InChI=1S/C20H22O4/c1-14-18(13-23-12-15-6-3-2-4-7-15)17(20-8-5-9-24-20)10-16(21)11-19(14)22/h2-9,14,17-18H,10-13H2,1H3/t14-,17-,18+/m1/s1