(1S,3R)-1-methyl-3-(4-methylpentyl)cyclohexane-1-carboxylic acid

Systemtic Name: (1S,3R)-1-methyl-3-(4-methylpentyl)cyclohexane-1-carboxylic acid Openeye Name: (1S,3R)-3-isohexyl-1-methyl-cyclohexanecarboxylic acid CAS Name: (1S,3R)-1-methyl-3-(4-methylpentyl)-1-cyclohexanecarboxylic acid IUPAC Name: (1S,3R)-1-methyl-3-(4-methylpentyl)cyclohexane-1-carboxylic acid Traditional Name: (1S,3R)-3-isohexyl-1-methyl-cyclohexanecarboxylic acid Formula: C14H26O2 MolecularWeight: 226.35504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1CCCC(C1)(C)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C14H26O2/c1-11(2)6-4-7-12-8-5-9-14(3,10-12)13(15)16/h11-12H,4-10H2,1-3H3,(H,15,16)/t12-,14+/m1/s1