(1R,2S,3R,6S)-3-methyl-2-(3-oxidanylidenebutyl)-6-propan-2-yl-cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S,3R,6S)-3-methyl-2-(3-oxidanylidenebutyl)-6-propan-2-yl-cyclohexane-1-carboxylic acid Openeye Name: (1R,2S,3R,6S)-6-isopropyl-3-methyl-2-(3-oxobutyl)cyclohexanecarboxylic acid CAS Name: (1R,2S,3R,6S)-3-methyl-2-(3-oxobutyl)-6-propan-2-yl-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S,3R,6S)-3-methyl-2-(3-oxobutyl)-6-propan-2-ylcyclohexane-1-carboxylic acid Traditional Name: (1R,2S,3R,6S)-6-isopropyl-2-(3-ketobutyl)-3-methyl-cyclohexanecarboxylic acid Formula: C15H26O3 MolecularWeight: 254.36514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1CCC(=O)C)C(=O)O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C15H26O3/c1-9(2)12-7-5-10(3)13(8-6-11(4)16)14(12)15(17)18/h9-10,12-14H,5-8H2,1-4H3,(H,17,18)/t10-,12+,13+,14-/m1/s1