(3R,5R)-7-[5-bromanyl-2-(2-phenylethanoyl)-3-propan-2-yl-imidazol-4-yl]-3,5-bis(oxidanyl)heptanoic acid

Systemtic Name: (3R,5R)-7-[5-bromanyl-2-(2-phenylethanoyl)-3-propan-2-yl-imidazol-4-yl]-3,5-bis(oxidanyl)heptanoic acid Openeye Name: (3R,5R)-7-[5-bromo-3-isopropyl-2-(2-phenylacetyl)imidazol-4-yl]-3,5-dihydroxy-heptanoic acid CAS Name: (3R,5R)-7-[5-bromo-2-(1-oxo-2-phenylethyl)-3-propan-2-yl-4-imidazolyl]-3,5-dihydroxyheptanoic acid IUPAC Name: (3R,5R)-7-[5-bromo-2-(2-phenylacetyl)-3-propan-2-ylimidazol-4-yl]-3,5-dihydroxyheptanoic acid Traditional Name: (3R,5R)-7-[5-bromo-3-isopropyl-2-(2-phenylacetyl)imidazol-4-yl]-3,5-dihydroxy-enanthic acid Formula: C21H27BrN2O5 MolecularWeight: 467.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(N=C1C(=O)CC2=CC=CC=C2)Br)CCC(CC(CC(=O)O)O)O

Isomeric SMILES

CC(C)N1C(=C(N=C1C(=O)CC2=CC=CC=C2)Br)CC[C@H](C[C@H](CC(=O)O)O)O

InChI

InChI=1S/C21H27BrN2O5/c1-13(2)24-17(9-8-15(25)11-16(26)12-19(28)29)20(22)23-21(24)18(27)10-14-6-4-3-5-7-14/h3-7,13,15-16,25-26H,8-12H2,1-2H3,(H,28,29)/t15-,16-/m1/s1