4-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-4-oxidanylidene-butanoic acid Openeye Name: 4-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]-4-oxo-butanoic acid CAS Name: 4-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxy-4-oxobutanoic acid IUPAC Name: 4-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxy-4-oxobutanoic acid Traditional Name: 4-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]-4-keto-butyric acid Formula: C14H24O4 MolecularWeight: 256.33796

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CCC(=O)O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H24O4/c1-9(2)11-5-4-10(3)8-12(11)18-14(17)7-6-13(15)16/h9-12H,4-8H2,1-3H3,(H,15,16)/t10-,11+,12-/m0/s1