(1R,2S,3S,4S,5R,6S)-3-chloranyl-4,5,6-tris(phenylmethoxy)cyclohexane-1,2-diol

Systemtic Name: (1R,2S,3S,4S,5R,6S)-3-chloranyl-4,5,6-tris(phenylmethoxy)cyclohexane-1,2-diol Openeye Name: (1S,2R,3S,4R,5S,6S)-3,4,5-tribenzyloxy-6-chloro-cyclohexane-1,2-diol CAS Name: (1R,2S,3S,4S,5R,6S)-3-chloro-4,5,6-tris(phenylmethoxy)cyclohexane-1,2-diol IUPAC Name: (1R,2S,3S,4S,5R,6S)-3-chloro-4,5,6-tris(phenylmethoxy)cyclohexane-1,2-diol Traditional Name: (1S,2R,3S,4R,5S,6S)-3,4,5-tribenzoxy-6-chloro-cyclohexane-1,2-diol Formula: C27H29ClO5 MolecularWeight: 468.96916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2C(C(C(C(C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)Cl)O)O

Isomeric SMILES

C1=CC=C(C=C1)CO[C@H]2[C@@H]([C@@H]([C@@H]([C@H]([C@@H]2OCC3=CC=CC=C3)OCC4=CC=CC=C4)Cl)O)O

InChI

InChI=1S/C27H29ClO5/c28-22-23(29)24(30)26(32-17-20-12-6-2-7-13-20)27(33-18-21-14-8-3-9-15-21)25(22)31-16-19-10-4-1-5-11-19/h1-15,22-27,29-30H,16-18H2/t22-,23+,24+,25+,26-,27-/m0/s1