butyl (2S,3R)-3-phenyloxirane-2-carboxylate

Systemtic Name: butyl (2S,3R)-3-phenyloxirane-2-carboxylate Openeye Name: butyl (2S,3R)-3-phenyloxirane-2-carboxylate CAS Name: (2S,3R)-3-phenyl-2-oxiranecarboxylic acid butyl ester IUPAC Name: butyl (2S,3R)-3-phenyloxirane-2-carboxylate Traditional Name: (2S,3R)-3-phenyloxirane-2-carboxylic acid butyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1C(O1)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)[C@@H]1[C@H](O1)C2=CC=CC=C2

InChI

InChI=1S/C13H16O3/c1-2-3-9-15-13(14)12-11(16-12)10-7-5-4-6-8-10/h4-8,11-12H,2-3,9H2,1H3/t11-,12+/m1/s1