[(2R)-1-imidazol-1-yl-3-phenoxy-propan-2-yl] 4-bromanylbenzoate

Systemtic Name: [(2R)-1-imidazol-1-yl-3-phenoxy-propan-2-yl] 4-bromanylbenzoate Openeye Name: [(1R)-1-(imidazol-1-ylmethyl)-2-phenoxy-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [(2R)-1-(1-imidazolyl)-3-phenoxypropan-2-yl] ester IUPAC Name: [(2R)-1-imidazol-1-yl-3-phenoxypropan-2-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [(1R)-1-(imidazol-1-ylmethyl)-2-phenoxy-ethyl] ester Formula: C19H17BrN2O3 MolecularWeight: 401.25388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CN2C=CN=C2)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)OC[C@@H](CN2C=CN=C2)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O3/c20-16-8-6-15(7-9-16)19(23)25-18(12-22-11-10-21-14-22)13-24-17-4-2-1-3-5-17/h1-11,14,18H,12-13H2/t18-/m1/s1