(2S,3R)-3-(4-bromophenyl)-2-(4-cyclohexylphenyl)-3-oxidanyl-propanoic acid

Systemtic Name: (2S,3R)-3-(4-bromophenyl)-2-(4-cyclohexylphenyl)-3-oxidanyl-propanoic acid Openeye Name: (2S,3R)-3-(4-bromophenyl)-2-(4-cyclohexylphenyl)-3-hydroxy-propanoic acid CAS Name: (2S,3R)-3-(4-bromophenyl)-2-(4-cyclohexylphenyl)-3-hydroxypropanoic acid IUPAC Name: (2S,3R)-3-(4-bromophenyl)-2-(4-cyclohexylphenyl)-3-hydroxypropanoic acid Traditional Name: (2S,3R)-3-(4-bromophenyl)-2-(4-cyclohexylphenyl)-3-hydroxy-propionic acid Formula: C21H23BrO3 MolecularWeight: 403.30952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(C(C3=CC=C(C=C3)Br)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)[C@@H]([C@H](C3=CC=C(C=C3)Br)O)C(=O)O

InChI

InChI=1S/C21H23BrO3/c22-18-12-10-17(11-13-18)20(23)19(21(24)25)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-14,19-20,23H,1-5H2,(H,24,25)/t19-,20-/m0/s1