methyl (1S,2R,5S)-5-methyl-2-oxidanyl-5-phenylselanyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2R,5S)-5-methyl-2-oxidanyl-5-phenylselanyl-cyclohexane-1-carboxylate Openeye Name: methyl (1S,2R,5S)-2-hydroxy-5-methyl-5-phenylselanyl-cyclohexanecarboxylate CAS Name: (1S,2R,5S)-2-hydroxy-5-methyl-5-(phenylseleno)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R,5S)-2-hydroxy-5-methyl-5-phenylselanylcyclohexane-1-carboxylate Traditional Name: (1S,2R,5S)-2-hydroxy-5-methyl-5-(phenylseleno)cyclohexanecarboxylic acid methyl ester Formula: C15H20O3Se MolecularWeight: 327.2775

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C(C1)C(=O)OC)O)[Se]C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C15H20O3Se/c1-15(19-11-6-4-3-5-7-11)9-8-13(16)12(10-15)14(17)18-2/h3-7,12-13,16H,8-10H2,1-2H3/t12-,13+,15-/m0/s1