methyl (1S,2R,3S)-3-oxidanyl-2-phenyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2R,3S)-3-oxidanyl-2-phenyl-cyclohexane-1-carboxylate Openeye Name: methyl (1S,2R,3S)-3-hydroxy-2-phenyl-cyclohexanecarboxylate CAS Name: (1S,2R,3S)-3-hydroxy-2-phenyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R,3S)-3-hydroxy-2-phenylcyclohexane-1-carboxylate Traditional Name: (1S,2R,3S)-3-hydroxy-2-phenyl-cyclohexanecarboxylic acid methyl ester Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC(C1C2=CC=CC=C2)O

Isomeric SMILES

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

InChI

InChI=1S/C14H18O3/c1-17-14(16)11-8-5-9-12(15)13(11)10-6-3-2-4-7-10/h2-4,6-7,11-13,15H,5,8-9H2,1H3/t11-,12-,13-/m0/s1