(2R,3S)-4-[(4-bromophenyl)methoxy]-2-methyl-butane-1,3-diol

Systemtic Name: (2R,3S)-4-[(4-bromophenyl)methoxy]-2-methyl-butane-1,3-diol Openeye Name: (2R,3S)-4-[(4-bromophenyl)methoxy]-2-methyl-butane-1,3-diol CAS Name: (2R,3S)-4-[(4-bromophenyl)methoxy]-2-methylbutane-1,3-diol IUPAC Name: (2R,3S)-4-[(4-bromophenyl)methoxy]-2-methylbutane-1,3-diol Traditional Name: (2R,3S)-4-(4-bromobenzyl)oxy-2-methyl-butane-1,3-diol Formula: C12H17BrO3 MolecularWeight: 289.16558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17BrO3/c1-9(6-14)12(15)8-16-7-10-2-4-11(13)5-3-10/h2-5,9,12,14-15H,6-8H2,1H3/t9-,12-/m1/s1