[(3S,5S)-2,6-dimethyl-5-oxidanyl-heptan-3-yl] 4-phenylselanylbutanoate

Systemtic Name: [(3S,5S)-2,6-dimethyl-5-oxidanyl-heptan-3-yl] 4-phenylselanylbutanoate Openeye Name: [(1S,3S)-3-hydroxy-1-isopropyl-4-methyl-pentyl] 4-phenylselanylbutanoate CAS Name: 4-(phenylseleno)butanoic acid [(3S,5S)-5-hydroxy-2,6-dimethylheptan-3-yl] ester IUPAC Name: [(3S,5S)-5-hydroxy-2,6-dimethylheptan-3-yl] 4-phenylselanylbutanoate Traditional Name: 4-(phenylseleno)butyric acid [(1S,3S)-3-hydroxy-1-isopropyl-4-methyl-pentyl] ester Formula: C19H30O3Se MolecularWeight: 385.3997

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O3Se/c1-14(2)17(20)13-18(15(3)4)22-19(21)11-8-12-23-16-9-6-5-7-10-16/h5-7,9-10,14-15,17-18,20H,8,11-13H2,1-4H3/t17-,18-/m0/s1