(2S,5R)-2-tert-butyl-5-methyl-5-(3-oxidanylidenecyclohexen-1-yl)-1,3-dioxolan-4-one

Systemtic Name: (2S,5R)-2-tert-butyl-5-methyl-5-(3-oxidanylidenecyclohexen-1-yl)-1,3-dioxolan-4-one Openeye Name: (2S,5R)-2-tert-butyl-5-methyl-5-(3-oxocyclohexen-1-yl)-1,3-dioxolan-4-one CAS Name: (2S,5R)-2-tert-butyl-5-methyl-5-(3-oxo-1-cyclohexenyl)-1,3-dioxolan-4-one IUPAC Name: (2S,5R)-2-tert-butyl-5-methyl-5-(3-oxocyclohexen-1-yl)-1,3-dioxolan-4-one Traditional Name: (2S,5R)-2-tert-butyl-5-(3-ketocyclohexen-1-yl)-5-methyl-1,3-dioxolan-4-one Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)OC(O1)C(C)(C)C)C2=CC(=O)CCC2

Isomeric SMILES

C[C@]1(C(=O)O[C@H](O1)C(C)(C)C)C2=CC(=O)CCC2

InChI

InChI=1S/C14H20O4/c1-13(2,3)12-17-11(16)14(4,18-12)9-6-5-7-10(15)8-9/h8,12H,5-7H2,1-4H3/t12-,14-/m1/s1