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

Systemtic Name: (1S,3R)-1-methyl-3-phenyl-cyclohexane-1-carboxylic acid Openeye Name: (1S,3R)-1-methyl-3-phenyl-cyclohexanecarboxylic acid CAS Name: (1S,3R)-1-methyl-3-phenyl-1-cyclohexanecarboxylic acid IUPAC Name: (1S,3R)-1-methyl-3-phenylcyclohexane-1-carboxylic acid Traditional Name: (1S,3R)-1-methyl-3-phenyl-cyclohexanecarboxylic acid Formula: C14H18O2 MolecularWeight: 218.29152

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C[C@@]1(CCC[C@H](C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H18O2/c1-14(13(15)16)9-5-8-12(10-14)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3,(H,15,16)/t12-,14+/m1/s1