methyl (1S,2R,5S)-5-(1,3-dioxolan-2-yl)-2-methyl-4-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2R,5S)-5-(1,3-dioxolan-2-yl)-2-methyl-4-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1S,2R,5S)-5-(1,3-dioxolan-2-yl)-2-methyl-4-oxo-cyclohexanecarboxylate CAS Name: (1S,2R,5S)-5-(1,3-dioxolan-2-yl)-2-methyl-4-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R,5S)-5-(1,3-dioxolan-2-yl)-2-methyl-4-oxocyclohexane-1-carboxylate Traditional Name: (1S,2R,5S)-5-(1,3-dioxolan-2-yl)-4-keto-2-methyl-cyclohexanecarboxylic acid methyl ester Formula: C12H18O5 MolecularWeight: 242.26832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(CC1C(=O)OC)C2OCCO2

Isomeric SMILES

C[C@@H]1CC(=O)[C@@H](C[C@@H]1C(=O)OC)C2OCCO2

InChI

InChI=1S/C12H18O5/c1-7-5-10(13)9(12-16-3-4-17-12)6-8(7)11(14)15-2/h7-9,12H,3-6H2,1-2H3/t7-,8+,9-/m1/s1