(1R,2S,4S)-2-methoxy-4-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S,4S)-2-methoxy-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: (1R,2S,4S)-2-methoxy-4-methyl-cyclohexanecarboxylic acid CAS Name: (1R,2S,4S)-2-methoxy-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S,4S)-2-methoxy-4-methylcyclohexane-1-carboxylic acid Traditional Name: (1R,2S,4S)-2-methoxy-4-methyl-cyclohexanecarboxylic acid Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O3/c1-6-3-4-7(9(10)11)8(5-6)12-2/h6-8H,3-5H2,1-2H3,(H,10,11)/t6-,7+,8-/m0/s1