methyl 3-[(1S,5S)-5-tert-butyl-2-oxidanylidene-cyclohexyl]propanoate

Systemtic Name: methyl 3-[(1S,5S)-5-tert-butyl-2-oxidanylidene-cyclohexyl]propanoate Openeye Name: methyl 3-[(1S,5S)-5-tert-butyl-2-oxo-cyclohexyl]propanoate CAS Name: 3-[(1S,5S)-5-tert-butyl-2-oxocyclohexyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(1S,5S)-5-tert-butyl-2-oxocyclohexyl]propanoate Traditional Name: 3-[(1S,5S)-5-tert-butyl-2-keto-cyclohexyl]propionic acid methyl ester Formula: C14H24O3 MolecularWeight: 240.33856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=O)C(C1)CCC(=O)OC

Isomeric SMILES

CC(C)(C)[C@H]1CCC(=O)[C@H](C1)CCC(=O)OC

InChI

InChI=1S/C14H24O3/c1-14(2,3)11-6-7-12(15)10(9-11)5-8-13(16)17-4/h10-11H,5-9H2,1-4H3/t10-,11-/m0/s1