ethyl (3S,4S,5S)-2-bromanyl-5-methoxy-2,4-dimethyl-3-oxidanyl-5-phenyl-pentanoate

Systemtic Name: ethyl (3S,4S,5S)-2-bromanyl-5-methoxy-2,4-dimethyl-3-oxidanyl-5-phenyl-pentanoate Openeye Name: ethyl (3S,4S,5S)-2-bromo-3-hydroxy-5-methoxy-2,4-dimethyl-5-phenyl-pentanoate CAS Name: (3S,4S,5S)-2-bromo-3-hydroxy-5-methoxy-2,4-dimethyl-5-phenylpentanoic acid ethyl ester IUPAC Name: ethyl (3S,4S,5S)-2-bromo-3-hydroxy-5-methoxy-2,4-dimethyl-5-phenylpentanoate Traditional Name: (3S,4S,5S)-2-bromo-3-hydroxy-5-methoxy-2,4-dimethyl-5-phenyl-valeric acid ethyl ester Formula: C16H23BrO4 MolecularWeight: 359.25542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C(C(C)C(C1=CC=CC=C1)OC)O)Br

Isomeric SMILES

CCOC(=O)C(C)([C@H]([C@H](C)[C@@H](C1=CC=CC=C1)OC)O)Br

InChI

InChI=1S/C16H23BrO4/c1-5-21-15(19)16(3,17)14(18)11(2)13(20-4)12-9-7-6-8-10-12/h6-11,13-14,18H,5H2,1-4H3/t11-,13+,14+,16?/m1/s1