ethyl (3S)-3-oxidanyl-3-[(2S)-1-[(1S)-1-phenylethyl]aziridin-2-yl]propanoate

Systemtic Name: ethyl (3S)-3-oxidanyl-3-[(2S)-1-[(1S)-1-phenylethyl]aziridin-2-yl]propanoate Openeye Name: ethyl (3S)-3-hydroxy-3-[(2S)-1-[(1S)-1-phenylethyl]aziridin-2-yl]propanoate CAS Name: (3S)-3-hydroxy-3-[(2S)-1-[(1S)-1-phenylethyl]-2-aziridinyl]propanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-hydroxy-3-[(2S)-1-[(1S)-1-phenylethyl]aziridin-2-yl]propanoate Traditional Name: (3S)-3-hydroxy-3-[(2S)-1-[(1S)-1-phenylethyl]ethylenimin-2-yl]propionic acid ethyl ester Formula: C15H21NO3 MolecularWeight: 263.33214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1CN1C(C)C2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)C[C@@H]([C@@H]1CN1[C@@H](C)C2=CC=CC=C2)O

InChI

InChI=1S/C15H21NO3/c1-3-19-15(18)9-14(17)13-10-16(13)11(2)12-7-5-4-6-8-12/h4-8,11,13-14,17H,3,9-10H2,1-2H3/t11-,13-,14-,16?/m0/s1