(1R,2S,3S,4R,6R)-4-bromanyl-2-phenylmethoxy-6-(phenylmethoxymethyl)cyclohexane-1,3-diol

Systemtic Name: (1R,2S,3S,4R,6R)-4-bromanyl-2-phenylmethoxy-6-(phenylmethoxymethyl)cyclohexane-1,3-diol Openeye Name: (1S,2S,3R,4R,6R)-2-benzyloxy-4-(benzyloxymethyl)-6-bromo-cyclohexane-1,3-diol CAS Name: (1R,2S,3S,4R,6R)-4-bromo-2-phenylmethoxy-6-(phenylmethoxymethyl)cyclohexane-1,3-diol IUPAC Name: (1R,2S,3S,4R,6R)-4-bromo-2-phenylmethoxy-6-(phenylmethoxymethyl)cyclohexane-1,3-diol Traditional Name: (1S,2S,3R,4R,6R)-2-benzoxy-4-(benzoxymethyl)-6-bromo-cyclohexane-1,3-diol Formula: C21H25BrO4 MolecularWeight: 421.3248

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(C1Br)O)OCC2=CC=CC=C2)O)COCC3=CC=CC=C3

Isomeric SMILES

C1[C@@H]([C@H]([C@@H]([C@@H]([C@@H]1Br)O)OCC2=CC=CC=C2)O)COCC3=CC=CC=C3

InChI

InChI=1S/C21H25BrO4/c22-18-11-17(14-25-12-15-7-3-1-4-8-15)19(23)21(20(18)24)26-13-16-9-5-2-6-10-16/h1-10,17-21,23-24H,11-14H2/t17-,18-,19-,20-,21+/m1/s1