[(2R,3S)-3-methyl-3-phenyl-aziridin-2-yl]methyl butanoate

Systemtic Name: [(2R,3S)-3-methyl-3-phenyl-aziridin-2-yl]methyl butanoate Openeye Name: [(2R,3S)-3-methyl-3-phenyl-aziridin-2-yl]methyl butanoate CAS Name: butanoic acid [(2R,3S)-3-methyl-3-phenyl-2-aziridinyl]methyl ester IUPAC Name: [(2R,3S)-3-methyl-3-phenylaziridin-2-yl]methyl butanoate Traditional Name: butyric acid [(2R,3S)-3-methyl-3-phenyl-ethylenimin-2-yl]methyl ester Formula: C14H19NO2 MolecularWeight: 233.30616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1C(N1)(C)C2=CC=CC=C2

Isomeric SMILES

CCCC(=O)OC[C@H]1[C@](N1)(C)C2=CC=CC=C2

InChI

InChI=1S/C14H19NO2/c1-3-7-13(16)17-10-12-14(2,15-12)11-8-5-4-6-9-11/h4-6,8-9,12,15H,3,7,10H2,1-2H3/t12-,14-/m0/s1