ethyl (4R,5R)-3-(4-bromophenyl)-5-(hydroxymethyl)-4,5-dihydro-1,2-oxazole-4-carboxylate

Systemtic Name: ethyl (4R,5R)-3-(4-bromophenyl)-5-(hydroxymethyl)-4,5-dihydro-1,2-oxazole-4-carboxylate Openeye Name: ethyl (4R,5R)-3-(4-bromophenyl)-5-(hydroxymethyl)-4,5-dihydroisoxazole-4-carboxylate CAS Name: (4R,5R)-3-(4-bromophenyl)-5-(hydroxymethyl)-4,5-dihydroisoxazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,5R)-3-(4-bromophenyl)-5-(hydroxymethyl)-4,5-dihydro-1,2-oxazole-4-carboxylate Traditional Name: (4R,5R)-3-(4-bromophenyl)-5-methylol-2-isoxazoline-4-carboxylic acid ethyl ester Formula: C13H14BrNO4 MolecularWeight: 328.15856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(ON=C1C2=CC=C(C=C2)Br)CO

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](ON=C1C2=CC=C(C=C2)Br)CO

InChI

InChI=1S/C13H14BrNO4/c1-2-18-13(17)11-10(7-16)19-15-12(11)8-3-5-9(14)6-4-8/h3-6,10-11,16H,2,7H2,1H3/t10-,11-/m0/s1