methyl (3S,4S)-2-bromanyl-2,4-dimethyl-3-oxidanyl-5-phenylmethoxy-pentanoate

Systemtic Name: methyl (3S,4S)-2-bromanyl-2,4-dimethyl-3-oxidanyl-5-phenylmethoxy-pentanoate Openeye Name: methyl (3S,4S)-5-benzyloxy-2-bromo-3-hydroxy-2,4-dimethyl-pentanoate CAS Name: (3S,4S)-2-bromo-3-hydroxy-2,4-dimethyl-5-phenylmethoxypentanoic acid methyl ester IUPAC Name: methyl (3S,4S)-2-bromo-3-hydroxy-2,4-dimethyl-5-phenylmethoxypentanoate Traditional Name: (3S,4S)-5-benzoxy-2-bromo-3-hydroxy-2,4-dimethyl-valeric acid methyl ester Formula: C15H21BrO4 MolecularWeight: 345.22884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC=CC=C1)C(C(C)(C(=O)OC)Br)O

Isomeric SMILES

C[C@@H](COCC1=CC=CC=C1)[C@@H](C(C)(C(=O)OC)Br)O

InChI

InChI=1S/C15H21BrO4/c1-11(13(17)15(2,16)14(18)19-3)9-20-10-12-7-5-4-6-8-12/h4-8,11,13,17H,9-10H2,1-3H3/t11-,13-,15?/m0/s1