[(2S,3R)-3-(hydroxymethyl)-1-(phenylmethyl)aziridin-2-yl]methyl ethanoate

Systemtic Name: [(2S,3R)-3-(hydroxymethyl)-1-(phenylmethyl)aziridin-2-yl]methyl ethanoate Openeye Name: [(2S,3R)-1-benzyl-3-(hydroxymethyl)aziridin-2-yl]methyl acetate CAS Name: acetic acid [(2S,3R)-3-(hydroxymethyl)-1-(phenylmethyl)-2-aziridinyl]methyl ester IUPAC Name: [(2S,3R)-1-benzyl-3-(hydroxymethyl)aziridin-2-yl]methyl acetate Traditional Name: acetic acid [(2S,3R)-1-benzyl-3-methylol-ethylenimin-2-yl]methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(N1CC2=CC=CC=C2)CO

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H](N1CC2=CC=CC=C2)CO

InChI

InChI=1S/C13H17NO3/c1-10(16)17-9-13-12(8-15)14(13)7-11-5-3-2-4-6-11/h2-6,12-13,15H,7-9H2,1H3/t12-,13+,14?/m0/s1