(2S,3R,4R,5R)-3,5-bis(furan-2-yl)-2-methyl-4-propanoyl-cyclohexan-1-one

Systemtic Name: (2S,3R,4R,5R)-3,5-bis(furan-2-yl)-2-methyl-4-propanoyl-cyclohexan-1-one Openeye Name: (2S,3R,4R,5R)-3,5-bis(2-furyl)-2-methyl-4-propanoyl-cyclohexanone CAS Name: (2S,3R,4R,5R)-3,5-bis(2-furanyl)-2-methyl-4-(1-oxopropyl)-1-cyclohexanone IUPAC Name: (2S,3R,4R,5R)-3,5-bis(furan-2-yl)-2-methyl-4-propanoylcyclohexan-1-one Traditional Name: (2S,3R,4R,5R)-3,5-bis(2-furyl)-2-methyl-4-propionyl-cyclohexanone Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C(CC(=O)C(C1C2=CC=CO2)C)C3=CC=CO3

Isomeric SMILES

CCC(=O)[C@@H]1[C@@H](CC(=O)[C@H]([C@H]1C2=CC=CO2)C)C3=CC=CO3

InChI

InChI=1S/C18H20O4/c1-3-13(19)18-12(15-6-4-8-21-15)10-14(20)11(2)17(18)16-7-5-9-22-16/h4-9,11-12,17-18H,3,10H2,1-2H3/t11-,12+,17+,18+/m1/s1